SCHEMBL6379189

SCHEMBL6379189

O=C1NC(=O)C(Oc2ccc(OCc3ccc(F)cc3)cc2)(C(F)(F)F)C(=O)N1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.49
▸ CTSB P07858 1/20 0.49
▸ MAOB P27338 10/20 0.47
▸ APP P05067 1/20 0.47
▸ PTPN1 P18031 1/20 0.46
▸ NR4A2 P43354 1/20 0.46
▸ MAOA P21397 2/20 0.45
▸ CA12 O43570 1/20 0.45
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ CA7 P43166 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ PARP10 Q53GL7 1/20 0.45
▸ MMP13 P45452 2/20 0.44
▸ MMP2 P08253 1/20 0.44
▸ AR P10275 1/20 0.41

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
SCHEMBL6383331 0.81 MMP13 (0.54) CTSLCTSBMAOBAPPPTPN1
SCHEMBL6378913 0.79 MMP13 (0.56) CTSLCTSBMAOBAPPPTPN1
SCHEMBL6379245 0.78 CTSL (0.48) CTSLCTSBMAOBAPPPTPN1
SCHEMBL6379044 0.76 MMP13 (0.50) CTSLCTSBMAOBAPPPTPN1
SCHEMBL6380903 0.75 MMP13 (0.46) CTSLCTSBMAOBAPPPTPN1
SCHEMBL6379256 0.75 MMP13 (0.59) CTSLCTSBMMP13
SCHEMBL6377050 0.74 MMP13 (0.54) CTSLCTSBMAOBAPPPTPN1
SCHEMBL6377388 0.74 MAOB (0.49) CTSLCTSBMAOBAPPPTPN1
SCHEMBL6378753 0.73 MMP13 (0.49) CTSLCTSBMAOBAPPPTPN1
SCHEMBL6380600 0.73 MMP13 (0.49) CTSLCTSBMAOBAPPPTPN1

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-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
EP-1202974-A1 PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS Pfizer Products Inc. (US) 2002-05-08 — — EP disclosed
WO-2001012611-A1 PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2001-02-22 — — WO disclosed
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