SCHEMBL7080942

SCHEMBL7080942

O=C(O)NCS(=O)(=O)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUT P33316 2/20 0.40
CYP2C19 P33261 1/20 0.40
ACLY P53396 1/20 0.39
TSHR P16473 2/20 0.39
LMNA P02545 1/20 0.39
MTOR P42345 1/20 0.38
RAB9A P51151 1/20 0.38
GRM7 Q14831 1/20 0.38
SRC P12931 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
BCAT2 O15382 1/20 0.38
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 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
SCHEMBL4557719 0.79 CYP2C19 (0.43) DUTCYP2C19ACLYTSHRLMNA
SCHEMBL4224462 0.79 CYP2C19 (0.55) DUTCYP2C19ACLYTSHRMTOR
SCHEMBL21596172 0.74 IDO1 (0.53) CYP2C19TSHRLMNAALDH1A1HPGD
SCHEMBL6264569 0.73 CA12 (0.49) DUTCYP2C19TSHRALDH1A1KMT2A
SCHEMBL6639307 0.73 LMNA (0.42) CYP2C19ACLYTSHRLMNASRC
SCHEMBL12696974 0.72 DUT (0.52) DUTACLYTSHRLMNAMTOR
SCHEMBL4910864 0.70 KMT2A (0.47) DUTTSHRKMT2ACA12CA2
SCHEMBL4046527 0.70 CYP2C19 (0.45) CYP2C19TSHRLMNAALDH1A1HPGD
SCHEMBL4910866 0.70 KMT2A (0.47) DUTTSHRKMT2ACA12CA2
SCHEMBL6265169 0.69 SLC6A9 (0.44) ACLYALDH1A1HPGDKMT2A

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-0592439-B1 AMINOSULFONYL CARBAMATES WARNER LAMBERT CO (US) 2003-07-30 EP claimed