SCHEMBL3907196

SCHEMBL3907196

Cc1cccc(CCNC(=O)NCCF)c1-c1cc(F)ccc1F

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 1/20 0.39
S1PR4 O95977 1/20 0.39
CNR1 P21554 2/20 0.38
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
OPRM1 P35372 4/20 0.36
OPRL1 P41146 3/20 0.36
OPRD1 P41143 2/20 0.36
OPRK1 P41145 2/20 0.36
MTNR1A P48039 5/20 0.36
HIF1A Q16665 1/20 0.35
CTSA P10619 1/20 0.35
NOTUM Q6P988 2/20 0.35
MTNR1B P49286 2/20 0.35
PKM P14618 1/20 0.34

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
SCHEMBL3910650 0.87 OPRM1 (0.43) CNR1MAPTSMN1; SMN2OPRM1OPRD1
SCHEMBL3915781 0.84 CNR1 (0.39) CNR1MAPTOPRM1OPRD1OPRK1
SCHEMBL3903152 0.84 OPRM1 (0.40) CNR1MAPTSMN1; SMN2OPRM1OPRL1
SCHEMBL3902047 0.83 MTNR1A (0.39) CNR1MAPTMTNR1AMTNR1B
SCHEMBL3907788 0.80 TAAR1 (0.49) S1PR2S1PR4MAPTSMN1; SMN2
SCHEMBL3902333 0.77 HIF1A (0.42) CNR1MAPTSMN1; SMN2HIF1A
SCHEMBL3906134 0.75 ROCK2 (0.40) MAPTSMN1; SMN2MTNR1AMTNR1B
SCHEMBL3907851 0.74 HIF1A (0.42) S1PR4MAPTOPRM1OPRD1OPRK1
SCHEMBL3905440 0.74 HIF1A (0.40) S1PR4MAPTSMN1; SMN2OPRM1MTNR1A
SCHEMBL3904588 0.74 P2RX7 (0.42) CNR1MAPTSMN1; SMN2MTNR1AMTNR1B

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-2018364-A1 THERAPEUTIC FLUOROETHYL UREAS Allergan, Inc. (US) 2009-01-28 EP claimed
WO-2007137029-A1 THERAPEUTIC FLUOROETHYL UREAS ALLERGAN, INC. (US) 2007-11-29 WO claimed
EP-2018364-A1 THERAPEUTIC FLUOROETHYL UREAS Allergan, Inc. (US) 2009-01-28 EP disclosed
WO-2007137029-A1 THERAPEUTIC FLUOROETHYL UREAS ALLERGAN, INC. (US) 2007-11-29 WO disclosed