SCHEMBL6975862

SCHEMBL6975862

Cc1cc(C(Oc2ccccc2)C(=O)O)ccc1NC(=O)NC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 1/20 0.42
▸ KMT2A Q03164 3/20 0.41
▸ LMNA P02545 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ PPARA Q07869 2/20 0.40
▸ RAB9A P51151 1/20 0.39
▸ KEAP1 Q14145 1/20 0.39
▸ NFE2L2 Q16236 1/20 0.39
▸ PPARG P37231 3/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ HPGD P15428 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL6984071 0.90 PPARG (0.45) RAF1KMT2APPARGMAPK1MEN1
SCHEMBL6973706 0.87 RAB9A (0.44) KMT2ALMNARAB9APPARGMAPK1
SCHEMBL6978533 0.87 MEN1 (0.46) KMT2ALMNAPPARARAB9APPARG
SCHEMBL6973224 0.85 PPARA (0.43) KMT2ALMNANPSR1PPARAKEAP1
SCHEMBL6978109 0.84 PPARG (0.41) KMT2ALMNAPPARAKEAP1NFE2L2
SCHEMBL25494271 0.78 MEN1 (0.45) KMT2ALMNANPSR1RAB9AMAPK1
SCHEMBL6983841 0.77 LMNA (0.38) RAF1KMT2ALMNANPSR1PPARA
SCHEMBL6979803 0.77 PPARG (0.45) KMT2APPARAKEAP1NFE2L2PPARG
SCHEMBL6981268 0.75 RAF1 (0.43) RAF1KMT2APPARARAB9APPARG
SCHEMBL6982722 0.73 KEAP1 (0.45) PPARARAB9AKEAP1NFE2L2PPARG

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-1030835-B1 UREA DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS ASTRAZENECA UK LTD (GB) 2003-01-22 — — EP disclosed
US-6344570-B1 ANTISTICKING AGENTS FOR CELLS ASTRAZENECA UK LIMITED (GB) 2002-02-05 — — US disclosed
EP-1030835-A2 UREA DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS AstraZeneca UK Limited (GB) 2000-08-30 — — EP disclosed
WO-1999024398-A2 UREA DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-05-20 — — WO disclosed
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