SCHEMBL8780764

SCHEMBL8780764

CCSc1ccc(N(C)C(C)=O)cc1S(=O)(=O)NC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.37
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
SRD5A1 P18405 3/20 0.34
MAPT P10636 5/20 0.34
ALDH1A1 P00352 4/20 0.33
LMNA P02545 4/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
HSD11B1 P28845 1/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
PDK2 Q15119 1/20 0.32
RAB9A P51151 2/20 0.32
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
CCR2 P41597 1/20 0.31

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
SCHEMBL8780958 0.82 ALOX15 (0.35) ACLYALOX15HSD17B10SRD5A1MAPT
SCHEMBL8780963 0.81 ACLY (0.39) ACLYALOX15HSD17B10SRD5A1MAPT
SCHEMBL8606043 0.75 NSD2 (0.40) MAPTALDH1A1LMNASMN1; SMN2RAB9A
SCHEMBL8780795 0.74 ALDH1A1 (0.38) MAPTALDH1A1LMNAMAPK1HTT
SCHEMBL8780812 0.73 ALDH1A1 (0.37) MAPTALDH1A1LMNAMAPK1HTT
SCHEMBL8780760 0.72 ACLY (0.33) ACLYALOX15HSD17B10MAPTLMNA
SCHEMBL6737493 0.71 NSD2 (0.44) ALOX15HSD17B10MAPTALDH1A1LMNA
SCHEMBL8536233 0.71 TBXA2R (0.47) ALOX15MAPTALDH1A1LMNASMN1; SMN2
SCHEMBL8603091 0.71 ALDH1A1 (0.35) MAPTALDH1A1LMNAMAPK1HTT
SCHEMBL8780949 0.64 ALOX15 (0.37) ACLYALOX15HSD17B10SRD5A1MAPT

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-0790985-A1 N-ACYL-N-ALKYLAMINO PHENYL SULPHONYL UREAS WITH SULPHUR SUBSTITUENTS, PROCESS FOR THEIR PRODUCTION AND USE AS HERBICIDES AND PLANT GROWTH REGULATORS Hoechst Schering AgrEvo GmbH (DE) 1997-08-27 EP disclosed
WO-1996014304-A1 N-ACYL-N-ALKYLAMINO PHENYL SULPHONYL UREAS WITH SULPHUR SUBSTITUENTS, PROCESS FOR THEIR PRODUCTION AND USE AS HERBICIDES AND PLANT GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 1996-05-17 WO disclosed