SCHEMBL5767735

SCHEMBL5767735

Cc1ccc(Cl)c2c(CCN(C)C)cn(C(=O)c3ccccc3Br)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.39
HTR6 P50406 4/20 0.36
HTR7 P34969 3/20 0.36
HTR1A P08908 1/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
HTR1F P30939 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
HDAC1 Q13547 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
ABCB1 P08183 1/20 0.33
HTR2B P41595 1/20 0.33
HPGD P15428 2/20 0.32
MGLL Q99685 1/20 0.32

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
SCHEMBL5767786 0.84 HTR6 (0.41) TAAR1HTR6HTR7HTR1AHTR1D
SCHEMBL5768381 0.84 TAAR1 (0.40) TAAR1HTR6HTR7HTR1AHTR1D
SCHEMBL5768419 0.82 HTR6 (0.41) TAAR1HTR6HTR7HTR1AHTR1D
SCHEMBL5793653 0.81 HTR6 (0.42) TAAR1HTR6HTR7HTR1AHTR1D
SCHEMBL5767683 0.81 HTR6 (0.42) TAAR1HTR6HTR7HTR1AHTR1D
SCHEMBL5768071 0.79 HTR6 (0.43) TAAR1HTR6HTR7HTR1AHTR1D
SCHEMBL6195999 0.78 HTR6 (0.43) TAAR1HTR6HTR7HTR1AHTR1D
SCHEMBL3251272 0.76 TAAR1 (0.49) TAAR1HTR6HDAC1HDAC10HDAC8
SCHEMBL5768435 0.75 TAAR1 (0.45) TAAR1HTR6HTR7HTR1AHTR1D
SCHEMBL5230117 0.75 HTR6 (0.45) TAAR1HTR6HTR7HTR1AHTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1517909-B1 NOVEL TETRACYCLIC ARYLCARBONYL INDOLES HAVING SEROTONIN RECEPTOR AFFINITY USEFUL AS THERAPEUTIC AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SUVEN LIFE SCIENCES LTD (IN) 2006-10-25 EP disclosed