SCHEMBL803640

SCHEMBL803640

COc1ccc(Cl)cc1C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.54
MAPK1 P28482 2/20 0.54
HTT P42858 1/20 0.54
EGFR P00533 1/20 0.50
ERBB2 P04626 1/20 0.50
KDM4E B2RXH2 6/20 0.48
GAA P10253 2/20 0.48
TRPV4 Q9HBA0 1/20 0.47
HPGD P15428 2/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX15 P16050 1/20 0.47
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
RBP4 P02753 2/20 0.43
RARA P10276 2/20 0.43
RARB P10826 2/20 0.43
RARG P13631 2/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10300149 0.84 TRPV4 (0.44) LMNAMAPK1HTTKDM4ETRPV4
SCHEMBL16579349 0.84 TRPV4 (0.44) LMNAMAPK1HTTEGFRERBB2
SCHEMBL803017 0.83 TRPV4 (0.56) LMNAMAPK1HTTEGFRERBB2
SCHEMBL12804704 0.81 NR3C1 (0.45) LMNAMAPK1HTTEGFRERBB2
SCHEMBL25952455 0.80 LMNA (0.48) LMNAMAPK1HTTKDM4EGAA
Hydrochloric Acid SCHEMBL27482054 0.80 LMNA (0.48) LMNAMAPK1HTTEGFRERBB2
SCHEMBL3433562 0.80 EGFR (0.42) LMNAMAPK1HTTEGFRERBB2
SCHEMBL12805397 0.80 NR3C1 (0.44) LMNAMAPK1HTTEGFRERBB2
SCHEMBL12401838 0.79 LMNA (0.57) LMNAMAPK1HTTKDM4EGAA
SCHEMBL12175420 0.79 TTR (0.55) LMNAMAPK1HTTKDM4EGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 76 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230271939-A1 4-ETHYNYLPYRIDINE DERIVATIVES USEFUL AS GCN2 INHIBITORS IP2IPO INNOVATIONS LIMITED (GB) 2023-08-31 US disclosed
US-20230271939-A1 4-ETHYNYLPYRIDINE DERIVATIVES USEFUL AS GCN2 INHIBITORS IP2IPO INNOVATIONS LIMITED (GB) 2023-08-31 US disclosed
US-20230265088-A1 The Method of the Preparation of Fused Multicyclic Compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2023-08-24 US disclosed
US-20230250082-A1 4-ETHYNYLPYRIDINE DERIVATIVES USEFUL AS GCN2 INHIBITORS IP2IPO INNOVATIONS LIMITED (GB) 2023-08-10 US disclosed
US-20230250082-A1 4-ETHYNYLPYRIDINE DERIVATIVES USEFUL AS GCN2 INHIBITORS IP2IPO INNOVATIONS LIMITED (GB) 2023-08-10 US disclosed
US-20230143059-A1 GCN2 MODULATOR COMPOUNDS Alesta Therapeutics BV (NL) 2023-05-11 US disclosed
US-20230143059-A1 GCN2 MODULATOR COMPOUNDS Alesta Therapeutics BV (NL) 2023-05-11 US disclosed
US-20230002361-A1 2H-INDAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE BIOGEN MA INC. 2023-01-05 US disclosed
US-11220479-B2 Glucosylceramide synthase inhibitors and therapeutic methods using the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2022-01-11 US disclosed
US-20210323910-A1 ADAMANTANYL-SUBSTITUTED BENZAMIDE COMPOUNDS AND THEIR USE AS P2X7 RECEPTOR ANTAGONISTS THE UNIVERSITY OF SYDNEY (AU) 2021-10-21 US disclosed
US-20070287705-A1 Crf Receptor Antagonists and Methods Relating Thereto NEUROCRINE BIOSCIENCES, INC. 2007-12-13 US disclosed
US-20070255065-A1 Benzodioxane and benzodioxolane derivatives and uses thereof WYETH (US) 2007-11-01 US disclosed
US-20070225365-A1 Cetp Inhibitors MERCK & CO., INC. (US) 2007-09-27 US disclosed
US-7265144-B2 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-04 US disclosed
US-20070179167-A1 Inhibitors of serine proteases VERTEX PHARMACEUTICALS INCORPORATED 2007-08-02 US disclosed
US-20070149506-A1 Azepine inhibitors of Janus kinases INCYTE CORPORATION 2007-06-28 US disclosed
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION 2007-02-22 US disclosed
US-20070027321-A1 Bipyridyl amines and ethers as modulators of metabotropic glutamate receptor-5 MERCK SHARP & DOHME CORP. 2007-02-01 US disclosed
US-20060241172-A1 Benzodioxane and benzodioxolane derivatives and uses thereof WYETH (US) 2006-10-26 US disclosed
US-20040152736-A1 Thrombin receptor antagonists TOPROL ACQUISITION LLC 2004-08-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (16 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230271939-A1 4-ETHYNYLPYRIDINE DERIVATIVES USEFUL AS GCN2 INHIBITORS EIF2AK4, GCN1, EIF5B LMNA 2905/4885MAPK1 2324/4885HTT 1027/4885
US-20070225365-A1 Cetp Inhibitors CETP, APOB, NPC1 LMNA 293/4885MAPK1 2498/4885HTT 1623/4885
US-20070287705-A1 Crf Receptor Antagonists and Methods Relating Thereto CRHR1, CRHR2, CRH LMNA 3501/4885MAPK1 4196/4885HTT 929/4885
US-20230250082-A1 4-ETHYNYLPYRIDINE DERIVATIVES USEFUL AS GCN2 INHIBITORS EIF2AK4, GCN1, EIF5B LMNA 2905/4885MAPK1 2324/4885HTT 1027/4885
US-20230265088-A1 The Method of the Preparation of Fused Multicyclic Compounds CYP2W1, CYP1B1, CYP2F1 LMNA 418/4885MAPK1 3387/4885HTT 3284/4885
US-20230143059-A1 GCN2 MODULATOR COMPOUNDS EIF2AK4, GPR119, GCN1 LMNA 3603/4885MAPK1 478/4885HTT 782/4885
US-20060241172-A1 Benzodioxane and benzodioxolane derivatives and uses thereof HTR2C, HTR1D, HTR1A LMNA 2921/4885MAPK1 2157/4885HTT 2102/4885
US-20040152736-A1 Thrombin receptor antagonists CNR1, TBXA2R, CNR2 LMNA 2885/4885MAPK1 2416/4885HTT 3552/4885
US-11220479-B2 Glucosylceramide synthase inhibitors and therapeutic methods using the same GBA1, GBA2, GAA LMNA 1219/4885MAPK1 4023/4885HTT 1334/4885
US-20230002361-A1 2H-INDAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE IRAK4, IRAK3, IRAK2 LMNA 3239/4885MAPK1 847/4885HTT 3351/4885
US-20210323910-A1 ADAMANTANYL-SUBSTITUTED BENZAMIDE COMPOUNDS AND THEIR USE AS P2X7 RECEPTOR ANTAGONISTS P2RX1, P2RX3, P2RX5 LMNA 1660/4885MAPK1 1888/4885HTT 1758/4885
US-20070027321-A1 Bipyridyl amines and ethers as modulators of metabotropic glutamate receptor-5 GRM5, GRIK5, GRM1 LMNA 4645/4885MAPK1 2462/4885HTT 2004/4885
US-20070179167-A1 Inhibitors of serine proteases PRSS1, PRSS3, PRSS2 LMNA 2814/4885MAPK1 971/4885HTT 3023/4885
US-20070255065-A1 Benzodioxane and benzodioxolane derivatives and uses thereof TBXA2R, HTR2C, NPY1R LMNA 1931/4885MAPK1 2616/4885HTT 2224/4885
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands CDKL2, CDK2, CDKL1 LMNA 3745/4885MAPK1 356/4885HTT 2605/4885
US-20070149506-A1 Azepine inhibitors of Janus kinases JAK1, JAK3, JAK2 LMNA 4785/4885MAPK1 73/4885HTT 4089/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.