SCHEMBL16758296

SCHEMBL16758296

CCCCNC(=O)NS(=O)(=O)c1ccccc1C

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.62
ALDH1A1 P00352 1/20 0.62
LMNA P02545 1/20 0.62
ALB P02768 1/20 0.62
TSHR P16473 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
CA9 Q16790 3/20 0.60
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
CA12 O43570 2/20 0.60
FBP1 P09467 7/20 0.60
TBXA2R P21731 5/20 0.57
HTT P42858 1/20 0.50

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
SCHEMBL8927342 0.83 FBP1 (0.55) CYP2C9ALDH1A1LMNAALBTSHR
SCHEMBL10642741 0.83 CYP2C9 (0.56) CYP2C9ALDH1A1LMNAALBTSHR
SCHEMBL28216426 0.83 CA1 (0.60) TSHRCA9CA1CA2CA12
SCHEMBL8448505 0.82 CYP2C9 (0.54) CYP2C9ALDH1A1LMNAALBTSHR
SCHEMBL10569228 0.82 CYP2C9 (0.54) CYP2C9ALDH1A1LMNAALBTSHR
SCHEMBL6464360 0.82 PTGER1 (0.59) CYP2C9ALDH1A1LMNAALBTSHR
SCHEMBL21667625 0.82 CA1 (0.59) CA9CA1CA2CA12FBP1
SCHEMBL8927096 0.81 CYP2C9 (0.53) CYP2C9ALDH1A1LMNAALBTSHR
SCHEMBL11119863 0.81 HTT (0.58) CYP2C9ALDH1A1LMNAALBTSHR
SCHEMBL28506678 0.81 CA1 (0.56) CYP2C9ALDH1A1LMNAALBTSHR

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-2015080665-A1 CHALCONE-UREA DERIVATIVES AS INSULIN SENSORS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-06-04 WO disclosed