SCHEMBL950306

SCHEMBL950306

Brc1nnnn1Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
P2RX7 Q99572 5/20 0.54
ALDH1A1 P00352 4/20 0.51
KMT2A Q03164 2/20 0.51
GRM2 Q14416 2/20 0.50
MEN1 O00255 1/20 0.49
SLC9A1 P19634 1/20 0.49
TSHR P16473 1/20 0.47
RAB9A P51151 1/20 0.47
IDO1 P14902 1/20 0.46
HDAC6 Q9UBN7 2/20 0.44
HDAC1 Q13547 1/20 0.44

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
SCHEMBL4408444 0.78 LMNA (0.59) LMNAP2RX7ALDH1A1KMT2AGRM2
SCHEMBL2163180 0.78 LMNA (0.59) LMNAP2RX7ALDH1A1KMT2AGRM2
SCHEMBL31272600 0.78 POLB (0.42) LMNAP2RX7ALDH1A1KMT2AGRM2
SCHEMBL7433479 0.78 ALDH1A1 (0.53) LMNAALDH1A1TSHR
SCHEMBL994214 0.77 LMNA (0.57) LMNAP2RX7ALDH1A1KMT2AGRM2
SCHEMBL4527137 0.77 LMNA (0.57) LMNAP2RX7ALDH1A1KMT2AGRM2
SCHEMBL3261613 0.77 LMNA (0.57) LMNAP2RX7ALDH1A1KMT2AGRM2
SCHEMBL3035928 0.77 LMNA (0.62) LMNAP2RX7ALDH1A1KMT2AGRM2
SCHEMBL1318724 0.77 LMNA (0.57) LMNAP2RX7ALDH1A1KMT2AGRM2
SCHEMBL27333607 0.77 LMNA (0.57) LMNAP2RX7ALDH1A1KMT2AGRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240276957-A1 METHODS OF TREATMENT WITH AMINOLEVULINIC ACID SYNTHASE 2 (ALAS2) MODULATORS AGIOS PHARMACEUTICALS, INC. 2024-08-22 US disclosed
CN-110003271-B Process for producing aromatic compound 住友化学株式会社 2022-05-03 CN disclosed
CN-114174288-A Methods of treatment with aminolevulinic acid synthase 2(ALAS2) modulators 安吉奥斯医药品有限公司 2022-03-11 CN disclosed
US-11045796-B2 Process for producing aromatic compound, and palladium complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-06-29 US disclosed
CN-108368142-B Method for producing aromatic compound and palladium complex 住友化学株式会社 2021-02-19 CN disclosed
WO-2020247819-A2 METHODS OF TREATMENT WITH AMINOLEVULINIC ACID SYNTHASE 2 (ALAS2) MODULATORS AGIOS PHARMACEUTICALS, INC. (US) 2020-12-10 WO disclosed
US-20200369653-A1 5-(2,5-BIS(4-CHLORO-2-ISOPROPYLPHENYL)THIOPHEN-3-YL)-1H-TETRAZOLE FOR THE TOPICAL TREATMENT OF BACTERIAL INFECTIONS DENOVAMED INC. (CA) 2020-11-26 US disclosed
US-20180369799-A1 PROCESS FOR PRODUCING AROMATIC COMPOUND, AND PALLADIUM COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-12-27 US disclosed
EP-3385270-A1 METHOD FOR PRODUCING AROMATIC COMPOUND, AND PALLADIUM COMPLEX Sumitomo Chemical Company, Ltd (JP) 2018-10-10 EP disclosed
US-9982087-B2 Method for producing compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-05-29 US disclosed
WO-2011004017-A1 1-(6 MEMBERS AZO-HETEROCYCLIC)-PYRROLIN-2-ONE COMPOUNDS AS INHIBITORS OF HEPATITIS C NS5B POLYMERASE, THE PHARMACEUTICAL COMPOSITION THEREOF AND THEIR THERAPEUTIC USE VIVALIS (FR) 2011-01-13 WO disclosed
EP-1859782-B1 Composition for coloring and/or lightening human hair comprising tetrazoles HENKEL AG & CO KGAA (DE) 2009-12-30 EP disclosed
US-20090306397-A1 Method for the production of substituted azoles LANXESS DEUTSCHLAND GMBH (DE) 2009-12-10 US disclosed
EP-1891025-A1 METHOD FOR THE PRODUCTION OF SUBSTITUTED AZOLES Lanxess Deutschland GmbH (DE) 2008-02-27 EP disclosed
EP-1859782-A1 Composition for coloring and/or lightening human hair comprising tetrazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed
WO-2006131228-A1 METHOD FOR THE PRODUCTION OF SUBSTITUTED AZOLES LANXESS DEUTSCHLAND GMBH (DE) 2006-12-14 WO disclosed
US-20060111593-A1 Coupling catalyst and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2006-05-25 US disclosed
US-7041856-B2 Coupling catalyst and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-05-09 US disclosed
US-20030162950-A1 Coupling catalyst and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2003-08-28 US disclosed
EP-1306131-A2 Cross-Coupling catalyst comprising a cyclic nitrogen ligand and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-05-02 EP 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 (6 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-20030162950-A1 Coupling catalyst and process using the same NOD1, PYM1, C9 LMNA 1888/4885P2RX7 1712/4885ALDH1A1 3293/4885
US-11045796-B2 Process for producing aromatic compound, and palladium complex DDT, DRD1, DRD2 LMNA 4732/4885P2RX7 1730/4885ALDH1A1 1822/4885
US-20200369653-A1 5-(2,5-BIS(4-CHLORO-2-ISOPROPYLPHENYL)THIOPHEN-3-YL)-1H-TETRAZOLE FOR THE TOPICAL TREATMENT OF BACTERIAL INFECTIONS TLR5, CUTA, IL5 LMNA 4304/4885P2RX7 894/4885ALDH1A1 1300/4885
US-20090306397-A1 Method for the production of substituted azoles CYP11B1, CYP11B2, CYP4F11 LMNA 3460/4885P2RX7 3267/4885ALDH1A1 389/4885
US-20060111593-A1 Coupling catalyst and process using the same RPL22, C9, RBM22 LMNA 1071/4885P2RX7 332/4885ALDH1A1 3723/4885
US-20180369799-A1 PROCESS FOR PRODUCING AROMATIC COMPOUND, AND PALLADIUM COMPLEX DDT, DRD1, DRD2 LMNA 4732/4885P2RX7 1730/4885ALDH1A1 1822/4885

“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.