SCHEMBL669693

SCHEMBL669693

NC(=O)N1CCNCC1c1ccccc1F

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 8/20 0.50
HTR2B P41595 8/20 0.50
DPP4 P27487 5/20 0.45
DPP7 Q9UHL4 2/20 0.45
TAAR1 Q96RJ0 1/20 0.44
HTR2A P28223 6/20 0.43
GAA P10253 1/20 0.39

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
SCHEMBL15824978 0.84 TAAR1 (0.43) HTR2CHTR2BTAAR1HTR2A
SCHEMBL17372630 0.82 HTR2C (0.58) HTR2CHTR2BDPP4DPP7TAAR1
SCHEMBL14698726 0.81 HTR2C (0.54) HTR2CHTR2BTAAR1HTR2AGAA
SCHEMBL30593287 0.81 HTR2C (0.54) HTR2CHTR2BTAAR1HTR2AGAA
SCHEMBL20556014 0.81 HTR2C (0.39) HTR2CHTR2BDPP4DPP7HTR2A
SCHEMBL2386164 0.81 DPP4 (0.47) HTR2CHTR2BDPP4DPP7TAAR1
Dimethylamine SCHEMBL27980772 0.80 HTR2C (0.47) HTR2CHTR2BDPP4TAAR1HTR2A
SCHEMBL6015072 0.80 HTR2C (0.43) HTR2CHTR2BHTR2A
Hydrochloric Acid SCHEMBL28773228 0.79 DPP4 (0.46) HTR2CHTR2BDPP4DPP7TAAR1
SCHEMBL30502301 0.79 HTR2C (0.44) HTR2CHTR2BDPP4DPP7TAAR1

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
WO-2012024179-A1 SUBSTITUTED AMIDE DERIVATIVES AS DGAT-1 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2012-02-23 WO disclosed