SCHEMBL7509259

SCHEMBL7509259

CCCCCNc1c(C(=O)c2ccccc2)[nH]c2cc(Cl)ccc12

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 3/20 0.51
▸ ALOX15 P16050 6/20 0.45
▸ MDM2 Q00987 2/20 0.43
▸ TSHR P16473 1/20 0.43

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
SCHEMBL7514688 0.94 ALOX15 (0.45) CNR1ALOX15MDM2TSHR
SCHEMBL7506995 0.90 ALOX15 (0.45) CNR1ALOX15MDM2TSHR
SCHEMBL7502916 0.89 CNR1 (0.41) CNR1
SCHEMBL7506988 0.89 CNR1 (0.41) CNR1
SCHEMBL7505691 0.87 ALOX15 (0.44) CNR1ALOX15MDM2
SCHEMBL7514736 0.85 ALOX15 (0.48) CNR1ALOX15TSHR
SCHEMBL7508929 0.84 ALOX15 (0.49) CNR1ALOX15TSHR
SCHEMBL7506263 0.84 ALOX15 (0.49) CNR1ALOX15TSHR
SCHEMBL7501257 0.84 ALOX15 (0.49) CNR1ALOX15TSHR
SCHEMBL7506242 0.84 ALOX15 (0.49) CNR1ALOX15TSHR

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-1001934-B1 INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER (US) 2002-11-27 — — EP disclosed
US-6300363-B1 USEFUL IN THE TREATMENT OR ALLEVIATION OF INFLAMMATION AND OTHER INFLAMMATION ASSOCIATED DISORDERS IN MAMMALS PFIZER INC. 2001-10-09 — — US disclosed
EP-1001934-A1 INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER PHARMACEUTICALS INC. (JP) 2000-05-24 — — EP disclosed
WO-1999005104-A1 INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER PHARMACEUTICALS INC. (JP) 1999-02-04 — — WO disclosed
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