SCHEMBL5248201

SCHEMBL5248201

COc1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)cc(OC)c3OC)c3ccccc23)ccn1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.67
SRC P12931 17/20 0.67
GSK3A P49840 14/20 0.67
SYK P43405 16/20 0.65

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
SCHEMBL5248359 0.90 MAPK14 (0.67) MAPK14SRCGSK3ASYK
SCHEMBL5251975 0.90 MAPK14 (0.61) MAPK14SRCGSK3ASYK
SCHEMBL5618979 0.90 MAPK14 (0.69) MAPK14SRCGSK3ASYK
SCHEMBL6547546 0.86 MAPK14 (0.62) MAPK14SRCGSK3ASYK
SCHEMBL6547129 0.85 MAPK14 (0.59) MAPK14SRCGSK3ASYK
SCHEMBL5250877 0.84 SRC (0.65) MAPK14SRCGSK3ASYK
SCHEMBL7568946 0.84 GSK3A (0.67) MAPK14SRCGSK3ASYK
SCHEMBL6545963 0.83 GSK3A (0.73) MAPK14SRCGSK3ASYK
SCHEMBL6546930 0.83 MAPK14 (0.63) MAPK14SRCGSK3ASYK
SCHEMBL6545663 0.83 GSK3A (0.70) MAPK14SRCGSK3ASYK

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 10 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-A1 UREA DERIVATIVES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2002-08-21 EP claimed
WO-2001036403-A1 UREA DERIVATIVES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2001-05-25 WO 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