SCHEMBL2603744

SCHEMBL2603744

CC(C)c1ccn[nH]c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
PARP1 P09874 1/20 0.35
PRKCI P41743 1/20 0.35
PDE4B Q07343 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HCAR2 Q8TDS4 1/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
POLB P06746 1/20 0.32
CHEK1 O14757 1/20 0.32
AURKA O14965 1/20 0.32
MAP4K4 O95819 1/20 0.32
ABL1 P00519 1/20 0.32
CSF1R P07333 1/20 0.32
RET P07949 1/20 0.32
MET P08581 1/20 0.32
FGFR1 P11362 1/20 0.32

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
SCHEMBL24878811 0.80 TSHR (0.37) HCAR2KDM4ECYP3A4CYP2C9L3MBTL1
SCHEMBL29414848 0.77 KMT2A (0.44) ALDH1A1KDM4ECYP3A4CYP2C9POLB
SCHEMBL3176093 0.72 KMT2A (0.56) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL18237982 0.71 ALDH1A1 (0.37) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL29731365 0.71 CYP4F2 (0.35) HCAR2MAPT
SCHEMBL1488645 0.70
SCHEMBL30777938 0.69 TSHR (0.37) PARP1HCAR2KDM4ECYP3A4CYP2C9
SCHEMBL1456892 0.69 HCAR2 (0.41) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL4258913 0.68 PKM (0.43) ALDH1A1KDM4ECYP3A4CYP2C9POLB
SCHEMBL75688 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240336629-A1 Tricyclic Derivatives Useful As PARP7 Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-10-10 US claimed
EP-3365335-B1 2-ARYL- AND 2-HETEROARYL-SUBSTITUTED 2-PYRIDAZIN-3(2H)-ONE COMPOUNDS AS INHIBITORS OF FGFR TYROSINE KINASES ARRAY BIOPHARMA INC (US) 2024-02-14 EP claimed
CN-113454069-B 1,2, 4-Triazine-3, 5-dione compound, and preparation method and application thereof 昆药集团股份有限公司 2025-03-14 CN disclosed
US-20250034120-A1 PYRIDAZINONES AS PARP7 INHIBITORS RIBON THERAPEUTICS, INC. 2025-01-30 US disclosed
US-20240336629-A1 Tricyclic Derivatives Useful As PARP7 Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-10-10 US disclosed
CN-118290483-A Pyridazinone compound and application thereof 烟台药物研究所 2024-07-05 CN disclosed
US-20240190855-A1 CDK INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2024-06-13 US disclosed
US-11986481-B2 Method of synthesizing thyroid hormone analogs and polymorphs thereof MADRIGAL PHARMACEUTICALS, INC. (US) 2024-05-21 US disclosed
US-20240148742-A1 METHOD OF SYNTHESIZING THYROID HORMONE ANALOGS AND POLYMORPHS THEREOF MADRIGAL PHARMACEUTICALS, INC. 2024-05-09 US disclosed
EP-4023641-B1 METHOD OF SYNTHESIZING THYROID HORMONE ANALOGS AND POLYMORPHS THEREOF MADRIGAL PHARMACEUTICALS INC (US) 2024-05-01 EP disclosed
WO-2024084491-A1 PROCESS FOR SYNTHESIS OF RES METIROM AND ITS INTERMEDIATES THEREOF MEHTA NILESH VIPINCHANDRA (IN) 2024-04-25 WO disclosed
WO-2011144622-A1 1H - IMIDAZO [4, 5 - C] QUINOLINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-24 WO disclosed
WO-2011131741-A1 HETEROCYCLIC CARBOXYLIC ACID AMIDES AS PDK1 INIHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-10-27 WO disclosed
US-7834000-B2 CGRP receptor antagonists VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-11-16 US disclosed
US-7834000-B2 CGRP receptor antagonists VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-11-16 US disclosed
WO-2010123451-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2010-10-28 WO disclosed
US-20090176769-A1 CGRP RECEPTOR ANTAGONISTS VERTEX PHARMACEUTICALS INCORPORATED 2009-07-09 US disclosed
US-20090176769-A1 CGRP RECEPTOR ANTAGONISTS VERTEX PHARMACEUTICALS INCORPORATED 2009-07-09 US disclosed
US-20080004261-A1 CGRP receptor antagonists VERTEX PHARMACEUTICALS INCORPORATED 2008-01-03 US disclosed
US-20080004261-A1 CGRP receptor antagonists VERTEX PHARMACEUTICALS INCORPORATED 2008-01-03 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 (7 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-11986481-B2 Method of synthesizing thyroid hormone analogs and polymorphs thereof THRB, TSHR, TRHR ALDH1A1 1879/4885PARP1 2263/4885PRKCI 1328/4885
US-20090176769-A1 CGRP RECEPTOR ANTAGONISTS CALCRL, CALCR, GRPR ALDH1A1 1645/4885PARP1 1702/4885PRKCI 4114/4885
US-20250034120-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 ALDH1A1 1033/4885PARP1 2/4885PRKCI 2548/4885
US-20240148742-A1 METHOD OF SYNTHESIZING THYROID HORMONE ANALOGS AND POLYMORPHS THEREOF THRB, TSHR, TRHR ALDH1A1 1879/4885PARP1 2263/4885PRKCI 1328/4885
US-20080004261-A1 CGRP receptor antagonists CALCRL, CALCR, GRPR ALDH1A1 1645/4885PARP1 1702/4885PRKCI 4114/4885
US-20240336629-A1 Tricyclic Derivatives Useful As PARP7 Inhibitors PARP1, PARP2, PARP11 ALDH1A1 1842/4885PARP1 1/4885PRKCI 987/4885
US-20240190855-A1 CDK INHIBITORS AND METHODS OF USE THEREOF CDK3, CDK8, CDK6 ALDH1A1 3717/4885PARP1 567/4885PRKCI 177/4885

“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.