SCHEMBL8751528

SCHEMBL8751528

OC1(c2ccc(F)cc2)CCCN(Cc2ccccc2)C1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.56
KMT2A Q03164 1/20 0.56
OPRL1 P41146 2/20 0.55
POLB P06746 1/20 0.54
CCR3 P51677 1/20 0.53
DRD2 P14416 2/20 0.51
DRD4 P21917 1/20 0.51
DRD3 P35462 1/20 0.51
CYP2D6 P10635 3/20 0.49
SIGMAR1 Q99720 1/20 0.48
CACNA1G O43497 6/20 0.48
RECQL P46063 1/20 0.47
OPRM1 P35372 1/20 0.46
OPRD1 P41143 1/20 0.46
OPRK1 P41145 1/20 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
SCHEMBL5242779 0.90 OPRL1 (0.67) KDM4EKMT2AOPRL1POLBCCR3
Hydrochloric Acid SCHEMBL10750648 0.89 POLB (0.68) KDM4EKMT2AOPRL1POLBCCR3
SCHEMBL8751541 0.86 KDM4E (0.56) KDM4EKMT2AOPRL1POLBCCR3
SCHEMBL19330902 0.86 KDM4E (0.56) KDM4EKMT2AOPRL1POLBCCR3
SCHEMBL8960154 0.86 OPRL1 (0.57) KDM4EKMT2AOPRL1POLBCCR3
Hydrochloric Acid SCHEMBL9310920 0.85 KDM4E (0.58) KDM4EKMT2AOPRL1POLBCCR3
SCHEMBL4265747 0.83 CYP2D6 (0.58) KDM4EKMT2AOPRL1POLBCCR3
SCHEMBL6110923 0.83 OPRL1 (0.79) KMT2AOPRL1POLBCCR3DRD2
SCHEMBL29017359 0.83 CACNA1G (0.56) KMT2APOLBDRD2CYP2D6SIGMAR1
SCHEMBL8969668 0.82 KDM4E (0.60) KDM4EKMT2AOPRL1POLBCCR3

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-0766562-A1 THERAPEUTICAL COMPOSITIONS COMPRISING 3-PHENYL-3-HYDROXYPIPERIDINES LABORATOIRE L. LAFON (FR) 1997-04-09 EP disclosed
EP-0691956-A1 3-PHENYL-1,2,5,6-TETRAHYDROPYRIDINE DERIVATIVES AS SEDATIVES LABORATOIRE L. LAFON (FR) 1996-01-17 EP disclosed
WO-1996000064-A1 THERAPEUTICAL COMPOSITIONS COMPRISING 3-PHENYL-3-HYDROXYPIPERIDINES LABORATOIRE L. LAFON (FR) 1996-01-04 WO disclosed
WO-1994022827-A1 3-PHENYL-1,2,5,6-TETRAHYDROPYRIDINE DERIVATIVES AS SEDATIVES LABORATOIRE L. LAFON (FR) 1994-10-13 WO disclosed