SCHEMBL6615754

SCHEMBL6615754

CC[N+](C)(Cn1cc(C2CC2)c2cc(C#N)ccc21)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.45
SLC6A4 P31645 9/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.41
SMO Q99835 1/20 0.39
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
RORC P51449 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
SCHEMBL6635822 0.71 SLC6A4 (0.56) HTR1ASLC6A4PTGDR2SMOCNR1
SCHEMBL6614701 0.71 SLC6A4 (0.44) HTR1ASLC6A4PTGDR2SMO
SCHEMBL6636440 0.70 SMO (0.54) HTR1ASLC6A4PTGDR2SMOCNR2
SCHEMBL6637096 0.70 HTR1A (0.53) HTR1ASLC6A4PTGDR2CNR1CNR2
SCHEMBL6087735 0.69 SLC6A4 (0.64) HTR1ASLC6A4PTGDR2SMO
SCHEMBL6087304 0.69 SLC6A4 (0.62) HTR1ASLC6A4PTGDR2CNR1CNR2
SCHEMBL6088184 0.69 SLC6A4 (0.62) HTR1ASLC6A4PTGDR2CNR1CNR2
SCHEMBL6087259 0.69 SLC6A4 (0.62) HTR1ASLC6A4PTGDR2CNR1CNR2
SCHEMBL6087263 0.69 SLC6A4 (0.62) HTR1ASLC6A4PTGDR2CNR1CNR2
SCHEMBL6087846 0.69 SLC6A4 (0.62) HTR1ASLC6A4PTGDR2CNR1CNR2

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
EP-1373203-A1 CYCLOPROPYLINDOLE DERIVATIVES AS SELECTIVE SEROTONIN REUPTAKE INHIBITORS Bristol-Myers Squibb Company (US) 2004-01-02 EP claimed
WO-2002079152-A1 CYCLOPROPYLINDOLE DERIVATIVES AS SELECTIVE SEROTONIN REUPTAKE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-10-10 WO claimed