SCHEMBL1077942

SCHEMBL1077942

CS(=O)(=O)N1CC=CC=C1C1=CCNCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.37
HTR6 P50406 9/20 0.35
SIGMAR1 Q99720 2/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
HTR1D P28221 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
QDPR P09417 1/20 0.33
HTR1A P08908 2/20 0.33
DRD3 P35462 2/20 0.33
HTR2A P28223 2/20 0.33
HTR7 P34969 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL6786592 0.68 HTR2C (0.36) HTR2CSIGMAR1KDM4EALDH1A1HSD17B10
SCHEMBL978347 0.67 TDP1 (0.35) HTR6CYP2D6
Hydrochloric Acid SCHEMBL979545 0.67 TDP1 (0.35) HTR6CYP2D6
Hydrochloric Acid SCHEMBL17455095 0.64 HTR2C (0.57) HTR2CHTR6SIGMAR1QDPR
SCHEMBL23074510 0.62 SIGMAR1 (0.46) HTR2CHTR6SIGMAR1KDM4EALDH1A1
SCHEMBL4261152 0.62 HTR2C (0.56) HTR2CSIGMAR1QDPR
SCHEMBL20913198 0.61 SIGMAR1 (0.60) HTR2CHTR6SIGMAR1QDPR
SCHEMBL9943846 0.59 HTR2C (0.39) HTR2CHTR6SIGMAR1QDPR
SCHEMBL1080407 0.59 RGS12 (0.30)
SCHEMBL28399652 0.59 HTR2C (0.46) HTR2CHTR6SIGMAR1KDM4EALDH1A1

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-2454251-A1 GPR119 AGONISTS Eli Lilly and Company (US) 2012-05-23 EP disclosed
WO-2011008663-A1 GPR119 AGONISTS ELI LILLY AND COMPANY (US) 2011-01-20 WO disclosed