SCHEMBL10901737

SCHEMBL10901737

Cc1cc2c(C3CCN(C)CC3)occ2cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.33
HTR1F P30939 2/20 0.31
QDPR P09417 1/20 0.31
USP7 Q93009 1/20 0.31
DRD4 P21917 1/20 0.31
CCNT1 O60563 1/20 0.31
CDK9 P50750 1/20 0.31
LSS P48449 1/20 0.30
TNK2 Q07912 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL10899401 0.88 PLG (0.36) PLGQDPRUSP7
SCHEMBL10900555 0.82 PLG (0.35) PLG
SCHEMBL2721295 0.79 HRH4 (0.40) DRD4LSS
SCHEMBL10899848 0.79 HRH4 (0.40) DRD4LSS
SCHEMBL10902493 0.77 CHRM2 (0.37) PLGQDPRCCNT1CDK9
SCHEMBL10903297 0.77 QDPR (0.36) PLGQDPRCCNT1CDK9TSHR
SCHEMBL10901823 0.76 QDPR (0.43) QDPR
SCHEMBL10902920 0.73 DRD2 (0.40) HTR1F
SCHEMBL10901399 0.73 MEN1 (0.38) PLGHTR1FQDPRDRD4LSS
SCHEMBL10899853 0.73 KDM4E (0.39) PLGQDPRUSP7ALDH1A1

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
US-4600719-A Tetrahydropyridine and piperidine derivatives CIBA GEIGY CORPORATION (US) 1986-07-15 US disclosed
US-4210655-A Anti-depressant benzofuranyl piperidines CIBA-GEIGY CORPORATION (US) 1980-07-01 US disclosed