SCHEMBL8891476

SCHEMBL8891476

OC1(c2ccc(Cl)cc2)CCCN(Cc2ccccc2)CC1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.89
OPRL1 P41146 5/20 0.73
POLB P06746 1/20 0.71
DRD4 P21917 5/20 0.66
DRD2 P14416 4/20 0.64
DRD3 P35462 4/20 0.64
OPRM1 P35372 3/20 0.59
CHRM4 P08173 1/20 0.56
MEN1 O00255 1/20 0.56
NPC1 O15118 1/20 0.56
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
HTR1A P08908 1/20 0.56
CHRM5 P08912 1/20 0.56
ADRA2A P08913 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
TSHR P16473 1/20 0.56
ADRA2B P18089 1/20 0.56

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
SCHEMBL653218 0.94 CCR3 (1.00) CCR3OPRL1POLBDRD4DRD2
Bromide SCHEMBL28537686 0.92 CCR3 (0.94) CCR3OPRL1POLBDRD4DRD2
SCHEMBL28525891 0.89 CCR3 (0.89) CCR3OPRL1POLBDRD4DRD2
SCHEMBL29087358 0.86 CCR3 (0.83) CCR3OPRL1POLBDRD4DRD2
SCHEMBL1411499 0.85 OPRL1 (1.00) CCR3OPRL1POLBDRD4OPRM1
SCHEMBL3890625 0.82 OPRL1 (0.82) CCR3OPRL1POLBDRD4DRD2
SCHEMBL27582059 0.82 CCR3 (0.82) CCR3OPRL1POLBDRD2DRD3
SCHEMBL6496650 0.81 CCR3 (0.74) CCR3OPRL1POLBDRD4DRD2
SCHEMBL6110923 0.81 OPRL1 (0.79) CCR3OPRL1POLBDRD4DRD2
SCHEMBL15530820 0.81 OPRL1 (0.79) CCR3OPRL1POLBDRD4OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997024325-A1 DIPHENYLMETHANE DERIVATIVES AS MIP-1α/RANTES RECEPTOR ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-07-10 WO disclosed