SCHEMBL27366320

SCHEMBL27366320

O=C(CCN1CCC[C@@H](Cc2ccccc2)C1)c1cc2c(cc1F)N[CH]N2

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.47
PRMT6 Q96LA8 1/20 0.47
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 1/20 0.44
CCR3 P51677 5/20 0.43
HTR2A P28223 3/20 0.43
BCHE P06276 1/20 0.42
GRIN2B Q13224 1/20 0.42
CYP2D6 P10635 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
SCHEMBL27390332 1.00 CARM1 (0.47) CARM1PRMT6CHRNB4CHRNA3CCR3
SCHEMBL8542199 0.84 CARM1 (0.46) CARM1PRMT6CHRNB4CHRNA3CCR3
SCHEMBL8548529 0.84 CARM1 (0.46) CARM1PRMT6CHRNB4CHRNA3CCR3
SCHEMBL8544330 0.74 CARM1 (0.46) CARM1PRMT6CHRNB4CHRNA3CCR3
SCHEMBL8543112 0.74 CARM1 (0.46) CARM1PRMT6CHRNB4CHRNA3CCR3
SCHEMBL8547957 0.74 CARM1 (0.45) CARM1PRMT6CHRNB4CHRNA3CCR3
SCHEMBL8547751 0.74 CARM1 (0.45) CARM1PRMT6CHRNB4CHRNA3CCR3
SCHEMBL8547953 0.73 GRIN2B (0.54) CARM1PRMT6HTR2AGRIN2B
SCHEMBL8547747 0.73 GRIN2B (0.54) CARM1PRMT6HTR2AGRIN2B
SCHEMBL8549788 0.72 GRIN2B (0.54) CARM1PRMT6HTR2AGRIN2B

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
CN-1064358-C Benzyl piperidine derivatives MERCK PATENT GMBH (DE) 2001-04-11 CN disclosed
CN-1128762-A Benzyl piperidine derivatives MERCK PATENT GMBH (DE) 1996-08-14 CN disclosed