SCHEMBL9492284

SCHEMBL9492284

CCC(CC=Cc1ccccc1)NCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 3/20 0.47
▸ SIGMAR1 Q99720 1/20 0.41
▸ RAB9A P51151 1/20 0.40
▸ CTSC P53634 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MMP1 P03956 1/20 0.40
▸ MMP2 P08253 1/20 0.40
▸ MMP9 P14780 1/20 0.40
▸ IDO1 P14902 2/20 0.39
▸ CNR2 P34972 1/20 0.37
▸ POLB P06746 1/20 0.36

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
SCHEMBL9878514 0.81 SIGMAR1 (0.56) HTR2ASIGMAR1RAB9ASMN1; SMN2MMP1
SCHEMBL9063683 0.79 SIGMAR1 (0.55) SIGMAR1SMN1; SMN2IDO1POLB
SCHEMBL9063693 0.79 SIGMAR1 (0.44) SIGMAR1SMN1; SMN2POLB
SCHEMBL13675824 0.79 SIGMAR1 (0.44) SIGMAR1SMN1; SMN2POLB
SCHEMBL4171219 0.73 ALDH1A1 (0.52) SIGMAR1SMN1; SMN2IDO1POLB
SCHEMBL1318063 0.73 ALDH1A1 (0.52) SIGMAR1SMN1; SMN2IDO1POLB
SCHEMBL21755741 0.73 SIGMAR1 (0.49) SIGMAR1IDO1POLB
SCHEMBL1848291 0.73 ALDH1A1 (0.52) SIGMAR1SMN1; SMN2IDO1POLB
SCHEMBL6286622 0.72 HTR2A (0.60) HTR2ASIGMAR1CTSCIDO1
SCHEMBL8825996 0.72 HTR2A (0.51) HTR2ARAB9AMMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0362001-B1 N-CYCLOALKYL BENZYLAMINES ALPHA,ALPHA DISUBSTITUTED, THE PROCESS FOR THEIR PREPARATION, THEIR USE AS DRUGS AND THEIR SYNTHESIS INTERMEDIATES JOUVEINAL S.A. (FR) 1993-03-10 — — EP disclosed
EP-0361990-B1 DISUBSTITUTED BENZYLAMINES, THE PROCESS FOR THEIR PREPARATION, THEIR USE AS DRUGS AND THEIR SYNTHESES INTERMEDIATES JOUVEINAL S.A. (FR) 1993-02-24 — — EP disclosed
US-5017723-A Psychotropic Agents JOUVEINAL S.A. (FR) 1991-05-21 — — US disclosed
EP-0362001-A1 N-cycloalkyl benzylamines alpha,alpha disubstituted, the process for their preparation, their use as drugs and their synthesis intermediates JOUVEINAL S.A. (FR) 1990-04-04 — — EP disclosed
EP-0361990-A1 Disubstituted benzylamines, the process for their preparation, their use as drugs and their syntheses intermediates JOUVEINAL S.A. (FR) 1990-04-04 — — EP disclosed
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