SCHEMBL6823982

SCHEMBL6823982

CN1CC[C@@H](Oc2cc(NS(=O)(=O)c3ccc(Sc4cccc(C(F)(F)F)c4)cc3Cl)ccc2Cl)C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 12/20 0.57
CDK1 P06493 1/20 0.42
CCNB1 P14635 1/20 0.42
CCNA2 P20248 1/20 0.42
CCND1 P24385 1/20 0.42
CDK2 P24941 1/20 0.42
CDK7 P50613 1/20 0.42
CCNH P51946 1/20 0.42
CCNA1 P78396 1/20 0.42
CDK6 Q00534 1/20 0.42
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SCD O00767 3/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
IDH1 O75874 2/20 0.37

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
SCHEMBL6823990 1.00 UTS2R (0.57) UTS2RCDK1CCNB1CCNA2CCND1
SCHEMBL6821285 0.94 UTS2R (0.61) UTS2RCDK1CCNB1CCNA2CCND1
SCHEMBL6821277 0.94 UTS2R (0.61) UTS2RCDK1CCNB1CCNA2CCND1
SCHEMBL8342830 0.88 UTS2R (0.64) UTS2RCDK1CCNB1CCNA2CCND1
SCHEMBL6823983 0.87 UTS2R (0.64) UTS2RALDH1A1
SCHEMBL6823993 0.87 UTS2R (0.64) UTS2RALDH1A1
SCHEMBL6821363 0.87 UTS2R (0.63) UTS2RSCD
SCHEMBL6823471 0.87 UTS2R (0.63) UTS2RSMN1; SMN2
SCHEMBL6823477 0.87 UTS2R (0.63) UTS2RSMN1; SMN2
SCHEMBL6821370 0.87 UTS2R (0.63) UTS2RSCD

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-2004043917-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed