SCHEMBL9003025

SCHEMBL9003025

FC1CCC(c2ccccc2)(c2ccccc2)C2CNCC12

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.36
OPRM1 P35372 1/20 0.33
HTR2A P28223 1/20 0.32
MAOB P27338 6/20 0.30
HTR1A P08908 2/20 0.30
MAOA P21397 3/20 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
SCHEMBL9268963 1.00 SSTR4 (0.36) SSTR4OPRM1HTR2AMAOBHTR1A
Hydrochloric Acid SCHEMBL9002825 0.98 SSTR4 (0.35) SSTR4OPRM1HTR2AMAOB
Hydrochloric Acid SCHEMBL9003158 0.98 SSTR4 (0.35) SSTR4OPRM1HTR2AMAOB
Hydrochloric Acid SCHEMBL9267897 0.98 SSTR4 (0.35) SSTR4OPRM1HTR2AMAOB
Hydrochloric Acid SCHEMBL9003453 0.98 SSTR4 (0.35) SSTR4OPRM1HTR2AMAOB
SCHEMBL9002948 0.81 SSTR4 (0.36) SSTR4OPRM1HTR2AHTR1A
SCHEMBL9003117 0.81 SSTR4 (0.39) SSTR4OPRM1HTR2AHTR1A
SCHEMBL9275122 0.81 SSTR4 (0.39) SSTR4OPRM1HTR2AHTR1A
SCHEMBL9003190 0.81 SSTR4 (0.39) SSTR4OPRM1HTR2AHTR1A
SCHEMBL9003016 0.81 SSTR4 (0.39) SSTR4OPRM1HTR2AHTR1A

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-5508433-A Derivatives of perhydroisoindole and preparation thereof RHONE-POULENC RORER S.A. (FR) 1996-04-16 US claimed
US-5508433-A Derivatives of perhydroisoindole and preparation thereof RHONE-POULENC RORER S.A. (FR) 1996-04-16 US disclosed