SCHEMBL164967

SCHEMBL164967

O=C(O)c1ccc2[nH]c(-c3ccc(C(F)(F)F)cc3)cc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPN P05981 1/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
MAPK1 P28482 2/20 0.49
MAP2K4 P45985 2/20 0.49
MAPK6 Q16659 2/20 0.49
MAPKAPK3 Q16644 1/20 0.49
P2RY14 Q15391 2/20 0.48
SLC6A2 P23975 1/20 0.48
F2 P00734 1/20 0.48
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
RXRG P48443 1/20 0.48
SRD5A2 P31213 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
CHEK2 O96017 1/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.47
HDAC11 Q96DB2 2/20 0.46

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
SCHEMBL2721413 0.84 HPN (0.50) HPNP2RY14F2HDAC6PTGDR2
SCHEMBL164956 0.84 CASP3 (0.57) HPNCASP3SENP8SENP7SENP6
SCHEMBL27077479 0.83 P2RY14 (0.54) CASP3SENP8SENP7SENP6MAPK1
SCHEMBL29893069 0.83 P2RY14 (0.54) CASP3SENP8SENP7SENP6MAPK1
SCHEMBL29784265 0.82 CASP3 (0.77) HPNCASP3SENP8SENP7SENP6
SCHEMBL979496 0.82 CASP3 (0.77) HPNCASP3SENP8SENP7SENP6
SCHEMBL11565448 0.81 CHEK2 (0.67) HPNCASP3SENP8SENP7SENP6
SCHEMBL4334503 0.81 CASP3 (0.57) CASP3SENP8SENP7SENP6F2
SCHEMBL693160 0.81 F2 (0.58) HPNCASP3SENP8SENP7SENP6
SCHEMBL11563588 0.81 CASP3 (0.57) CASP3SENP8SENP7SENP6MAPK1

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-2611774-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2013-07-10 EP disclosed
WO-2012030907-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2012-03-08 WO disclosed