SCHEMBL14459488

SCHEMBL14459488

COc1c(NC(=O)Nc2ccc(Oc3ccncc3)c3ccccc23)cc(C(C)(C)C)cc1NC(=O)N(C)C

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.60
GSK3A P49840 13/20 0.57
SRC P12931 15/20 0.57
SYK P43405 15/20 0.57

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
SCHEMBL14459485 0.91 MAPK14 (0.60) MAPK14GSK3ASRCSYK
SCHEMBL6298751 0.88 GSK3A (0.67) MAPK14GSK3ASRCSYK
SCHEMBL5249388 0.88 MAPK14 (0.49) MAPK14GSK3ASRCSYK
SCHEMBL14459482 0.86 GSK3A (0.68) MAPK14GSK3ASRCSYK
SCHEMBL6840076 0.86 GSK3A (0.67) MAPK14GSK3ASRCSYK
SCHEMBL6547129 0.85 MAPK14 (0.59) MAPK14GSK3ASRCSYK
SCHEMBL6545894 0.84 MAPK14 (0.59) MAPK14GSK3ASRCSYK
SCHEMBL14459484 0.83 GSK3A (0.62) MAPK14GSK3ASRCSYK
SCHEMBL6545663 0.82 GSK3A (0.70) MAPK14GSK3ASRCSYK
SCHEMBL6546013 0.81 GSK3A (0.69) MAPK14GSK3ASRCSYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241758-B2 Compounds useful as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-07-10 US disclosed
US-7241758-B2 Compounds useful as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-07-10 US disclosed