SCHEMBL105045

SCHEMBL105045

Clc1cc2ncccc2s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.42
ALOX5 P09917 1/20 0.41
CYP2A6 P11509 1/20 0.41
ALDH1A1 P00352 6/20 0.39
KDM4E B2RXH2 4/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CASP6 P55212 1/20 0.39
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2C Q14957 1/20 0.38
MAPT P10636 2/20 0.38
POLB P06746 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.35
NAMPT P43490 1/20 0.35

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
SCHEMBL31001832 1.00 NR4A2 (0.42) NR4A2ALOX5CYP2A6ALDH1A1KDM4E
SCHEMBL28017683 0.78 ALOX5 (0.43) NR4A2ALOX5ALDH1A1KDM4ENPC1
SCHEMBL1479681 0.77 ALOX5 (0.42) NR4A2ALOX5ALDH1A1KDM4ENPC1
SCHEMBL1107218 0.75 ALOX5 (0.48) NR4A2ALOX5ALDH1A1KDM4ENPC1
SCHEMBL8113780 0.75 ALOX5 (0.41) NR4A2ALOX5ALDH1A1KDM4ENPC1
SCHEMBL4710724 0.75 ALOX5 (0.44) NR4A2ALOX5ALDH1A1KDM4ENPC1
SCHEMBL306185 0.75 HTT (0.42) NR4A2ALOX5ALDH1A1KDM4ENPC1
SCHEMBL16023610 0.75 ALOX5 (0.41) NR4A2ALOX5CYP2A6ALDH1A1KDM4E
SCHEMBL3483357 0.75 ALOX5 (0.44) ALOX5ALDH1A1KDM4ENPC1RAB9A
SCHEMBL29153739 0.75 ALOX5 (0.41) NR4A2ALOX5ALDH1A1KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250289830-A1 KRAS INHIBITORS ELI LILLY AND COMPANY 2025-09-18 US disclosed
US-12351591-B2 KRas inhibitors ELI LILLY AND COMPANY (US) 2025-07-08 US disclosed
EP-4499233-A1 KRAS INHIBITORS Eli Lilly and Company (US) 2025-02-05 EP disclosed
US-20240043451-A1 KRAS INHIBITORS ELI LILLY AND COMPANY 2024-02-08 US disclosed
WO-2023183585-A1 KRAS INHIBITORS ELI LILLY AND COMPANY (US) 2023-09-28 WO disclosed
US-9556135-B2 Amino-dihydrothiazine and amino-dioxido dihydrothiazine compounds as beta-secretase antagonists and methods of use AMGEN, INC. (US) 2017-01-31 US disclosed
EP-2426108-B1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC (CA) 2016-08-10 EP disclosed
US-20150259308-A1 AMINO-DIHYDROTHIAZINE AND AMINO-DIOXIDO DIHYDROTHIAZINE COMPOUNDS AS BETA-SECRETASE ANTAGONISTS AND METHODS OF USE AMGEN INC. (US) 2015-09-17 US disclosed
US-9018378-B2 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC. (CA) 2015-04-28 US disclosed
US-8906852-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-12-09 US disclosed
EP-2183255-A1 PROCESSES AND INTERMEDIATES FOR PREPARING FUSED HETEROCYCLIC KINASE INHIBITORS MethylGene Inc. (CA) 2010-05-12 EP disclosed
US-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors Mirati Therapeutics, Inc. 2009-11-19 US disclosed
WO-2009026720-A1 PROCESSES AND INTERMEDIATES FOR PREPARING FUSED HETEROCYCLIC KINASE INHIBITORS METHYLGENE INC. (CA) 2009-03-05 WO disclosed
EP-0604114-B1 Diaryl 5,6-fusedheterocyclic acids as leukotriene antagonists MERCK FROSST CANADA INC (CA) 2000-05-03 EP disclosed
CN-1148389-A Diaryl 5, 6-fused heterocyclic acids as leukotriene antagonists MERCK FROSST CANADA INC (CA) 1997-04-23 CN disclosed
EP-0737196-A1 DIARYL 5,6-FUSED HETEROCYCLIC ACIDS AS LEUKOTRIENE ANTAGONISTS MERCK FROSST CANADA INC. (CA) 1996-10-16 EP disclosed
US-5472964-A Diaryl 5,6-fused heterocyclic acids as leukotriene antagonists MERCK FROSST CANADA, INC. (CA) 1995-12-05 US disclosed
WO-1995018132-A1 DIARYL 5,6-FUSED HETEROCYCLIC ACIDS AS LEUKOTRIENE ANTAGONISTS MERCK FROSST CANADA INC. (CA) 1995-07-06 WO disclosed
WO-1994014815-A1 DIARYL 5,6-FUSEDHETEROCYCLIC ACIDS AS LEUKOTRIENE ANTAGONISTS MERCK FROSST CANADA INC. (CA) 1994-07-07 WO disclosed
EP-0604114-A1 Diaryl 5,6-fusedheterocyclic acids as leukotriene antagonists MERCK FROSST CANADA INC. (CA) 1994-06-29 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 (5 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-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors MAP3K19, MAP3K9, MAP4K2 NR4A2 3600/4885ALOX5 3397/4885CYP2A6 2042/4885
US-20240043451-A1 KRAS INHIBITORS KRAS, NRAS, HRAS NR4A2 3210/4885ALOX5 4777/4885CYP2A6 2972/4885
US-12351591-B2 KRas inhibitors KRAS, NRAS, HRAS NR4A2 3210/4885ALOX5 4777/4885CYP2A6 2972/4885
US-20250289830-A1 KRAS INHIBITORS KRAS, NRAS, HRAS NR4A2 3210/4885ALOX5 4777/4885CYP2A6 2972/4885
US-20150259308-A1 AMINO-DIHYDROTHIAZINE AND AMINO-DIOXIDO DIHYDROTHIAZINE COMPOUNDS AS BETA-SECRETASE ANTAGONISTS AND METHODS OF USE BACE1, BACE2, APP NR4A2 563/4885ALOX5 1254/4885CYP2A6 259/4885

“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.