SCHEMBL6380934

SCHEMBL6380934

CC1(Oc2ccc(OCc3ccc(F)cc3C(F)(F)F)cc2)C(=O)NC(=O)NC1=O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MMP13 P45452 5/20 0.45
▸ IDO1 P14902 2/20 0.45
▸ MAOB P27338 4/20 0.39
▸ PPARD Q03181 1/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ MAOA P21397 1/20 0.39
▸ ADAM17 P78536 1/20 0.37
▸ MMP2 P08253 1/20 0.37
▸ P2RX7 Q99572 1/20 0.36
▸ DRD2 P14416 1/20 0.36
▸ FFAR4 Q5NUL3 1/20 0.36
▸ FOXM1 Q08050 1/20 0.36
▸ MMP14 P50281 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
SCHEMBL6381248 0.85 MMP13 (0.48) MMP13MAOBADAM17MMP2MMP14
SCHEMBL6382809 0.84 MMP13 (0.53) MMP13MAOBADAM17MMP2MMP14
SCHEMBL6375122 0.80 MMP13 (0.43) MMP13MAOBMAOAADAM17MMP2
SCHEMBL6383331 0.78 MMP13 (0.54) MMP13MAOBMAOAMMP2MMP14
SCHEMBL6377995 0.77 MMP13 (0.60) MMP13MAOBADAM17MMP2MMP14
SCHEMBL222118 0.72 MMP13 (0.63) MMP13MMP2MMP14
SCHEMBL6377947 0.72 MMP13 (0.63) MMP13MMP2MMP14
SCHEMBL6377111 0.70 MMP13 (0.70) MMP13MAOBMAOAADAM17MMP2
SCHEMBL6377105 0.68 MMP14 (0.60) MMP13MMP2MMP14
SCHEMBL6382057 0.68 MMP13 (0.75) MMP13MAOBMAOAMMP2MMP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1202974-B1 PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PROD INC (US) 2005-11-09 — — EP disclosed
US-6579982-B1 Treating inflammation, cancer PFIZER INC. 2003-06-17 — — US disclosed
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