SCHEMBL7484615

SCHEMBL7484615

Cc1ccnc(C(=O)c2[nH]c3cc(C)ccc3c2Cc2nnn[nH]2)c1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.56
PTGS1 P23219 7/20 0.56
EGFR P00533 1/20 0.35
MCL1 Q07820 1/20 0.33

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
SCHEMBL7484772 0.92 PTGS2 (0.52) PTGS2PTGS1MCL1
SCHEMBL7484382 0.92 PTGS2 (0.68) PTGS2PTGS1EGFR
SCHEMBL7481159 0.90 PTGS2 (0.52) PTGS2PTGS1MCL1
SCHEMBL7482305 0.86 PTGS2 (0.52) PTGS2PTGS1
SCHEMBL7479173 0.86 PTGS2 (0.68) PTGS2PTGS1
SCHEMBL7486073 0.84 PTGS2 (0.58) PTGS2PTGS1EGFR
SCHEMBL7482841 0.84 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL7480098 0.81 PTGS2 (0.50) PTGS2PTGS1
SCHEMBL7484432 0.81 PTGS2 (0.48) PTGS2PTGS1MCL1
SCHEMBL7484972 0.80 PTGS2 (0.51) PTGS2PTGS1MCL1

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-1065206-B1 Tetrazolylalkyl indole compounds as anti-inflammatory and analgesic agents PFIZER (US) 2002-10-09 EP claimed
EP-1065206-A1 Tetrazolylalkyl indole compounds as anti-inflammatory and analgesic agents PFIZER INC. (US) 2001-01-03 EP claimed
EP-1065206-B1 Tetrazolylalkyl indole compounds as anti-inflammatory and analgesic agents PFIZER (US) 2002-10-09 EP disclosed
EP-1065206-A1 Tetrazolylalkyl indole compounds as anti-inflammatory and analgesic agents PFIZER INC. (US) 2001-01-03 EP disclosed