SCHEMBL27485366

SCHEMBL27485366

N#Cc1ccc2c(ccn2C2CCC(=O)CC2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.38
RORC P51449 1/20 0.36
PRMT5 O14744 1/20 0.36
CYP11B2 P19099 2/20 0.36
ENPP3 O14638 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
ACLY P53396 1/20 0.35
GRM2 Q14416 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
NPY5R Q15761 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
HTR2A P28223 1/20 0.34
HTR7 P34969 1/20 0.34

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
SCHEMBL7927986 0.88 CDC7 (0.43) CDC7RORCPRMT5CYP11B2ENPP3
SCHEMBL7856860 0.84 KDM4E (0.43) CDC7RORCCYP11B2ENPP3KDM4E
SCHEMBL25766341 0.78 HTR2A (0.43) CDC7PRMT5ENPP3KDM4EALDH1A1
SCHEMBL565952 0.78 HTR7 (0.38) CYP11B2HTR2AHTR7KDM4C
SCHEMBL25766275 0.77 HTR6 (0.39) CDC7PRMT5ENPP3KDM4EALDH1A1
SCHEMBL12391648 0.76 NOS3 (0.49) RORCHRH3HTR2AHTR7P2RX7
SCHEMBL20340238 0.76 CDC7 (0.46) CDC7RORCPRMT5CYP11B2KDM4E
SCHEMBL20837893 0.75 CYP11B2 (0.39) CYP11B2CA1CA2
SCHEMBL30808812 0.75 CDC7 (0.38) CDC7RORCCYP11B2ENPP3KDM4E
SCHEMBL28985534 0.72 CDC7 (0.36) CDC7PRMT5ENPP3KDM4EALDH1A1

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-1166636-C Arylpiperazinyl-cyclohexylindole derivatives for the treatment of depression 2004-09-15 CN disclosed
CN-1336916-A Arylpiperazinyl-cyclohexyl indole derivatives for the treatment of depression AMERICAN HOME PROD (US) 2002-02-20 CN disclosed