SCHEMBL5250877

SCHEMBL5250877

COc1cc(C(C)(C)C)cc(NC(=O)Nc2ccc(Oc3ccnc(NC(C)c4ccccc4)c3)c3ccccc23)c1OC

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SRC P12931 14/20 0.65
SYK P43405 14/20 0.65
GSK3A P49840 14/20 0.65
MAPK14 Q16539 12/20 0.65
LCK P06239 1/20 0.60

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
SCHEMBL5251074 0.91 MAPK14 (0.59) SRCSYKGSK3AMAPK14LCK
SCHEMBL5618979 0.88 MAPK14 (0.69) SRCSYKGSK3AMAPK14
SCHEMBL5247579 0.88 MAPK14 (0.57) SRCSYKGSK3AMAPK14
SCHEMBL5248201 0.84 MAPK14 (0.67) SRCSYKGSK3AMAPK14
SCHEMBL7568946 0.84 GSK3A (0.67) SRCSYKGSK3AMAPK14LCK
SCHEMBL5248359 0.84 MAPK14 (0.67) SRCSYKGSK3AMAPK14
SCHEMBL5252675 0.84 MAPK14 (0.45) SRCSYKGSK3AMAPK14LCK
SCHEMBL16106646 0.80 MAPK14 (0.80) SRCSYKGSK3AMAPK14
SCHEMBL16829415 0.79 SRC (1.00) SRCSYKGSK3AMAPK14
SCHEMBL6547033 0.79 MAPK14 (0.59) SRCSYKGSK3AMAPK14LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1232150-B1 UREA DERIVATIVES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMA (US) 2007-10-10 EP claimed
EP-1232150-B1 UREA DERIVATIVES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMA (US) 2007-10-10 EP disclosed
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
US-7241758-B2 Compounds useful as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-07-10 US disclosed
US-6492393-B1 SUCH AS 1-(5-TERT-BUTYL-2-METHOXYPHENYL)-3-(4-(2-METHOXY-PYRIDIN-4YL-OXY)-NAPHTHALEN-1-YL)-UREA; CYTOKINE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2002-12-10 US disclosed
EP-1232150-A1 UREA DERIVATIVES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2002-08-21 EP disclosed
WO-2001036403-A1 UREA DERIVATIVES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2001-05-25 WO disclosed