SCHEMBL5670844

SCHEMBL5670844

CC1=C(Cl)Nc2ccccc2O1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.56
DHODH Q02127 1/20 0.40
PARP1 P09874 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 3/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
TP53 P04637 2/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL16306323 0.79 ALOX5 (0.60) ALOX5DHODHPARP1MEN1KMT2A
SCHEMBL5671666 0.77 AHR (0.42) LMNATP53POLB
SCHEMBL5671428 0.77 MMP12 (0.45) MEN1KMT2AMAPTGAABRD4
SCHEMBL5670592 0.76 ALOX5 (0.56) ALOX5DHODHPARP1MEN1KMT2A
SCHEMBL21115127 0.74 ALOX5 (0.65) ALOX5DHODHPARP1MEN1KMT2A
SCHEMBL16306316 0.73 ALOX5 (0.52) ALOX5PARP1MEN1KMT2AMAPT
Phenoxazine SCHEMBL6310178 0.73 ALOX5 (1.00) ALOX5DHODHPARP1MEN1KMT2A
Phenoxazine SCHEMBL28844098 0.73 ALOX5 (1.00) ALOX5DHODHPARP1MEN1KMT2A
Phenoxazine SCHEMBL29355714 0.73 ALOX5 (1.00) ALOX5DHODHPARP1MEN1KMT2A
Phenoxazine SCHEMBL7862 0.73 ALOX5 (1.00) ALOX5DHODHPARP1MEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0980362-B1 SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS SCHERING AG (DE) 2006-08-16 EP disclosed
US-6191127-B1 ANTIINFLAMMATORY AGENTS, AUTOIMMUNE DISEASES, CARDIOVASCULAR DISORDERS, NERVOUS SYSTEM DISORDERS SCHERING AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0980362-A1 SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS SCHERING AKTIENGESELLSCHAFT (DE) 2000-02-23 EP disclosed
WO-1998050372-A1 SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS SCHERING AKTIENGESELLSCHAFT (DE) 1998-11-12 WO disclosed