SCHEMBL8416374

SCHEMBL8416374

CCNc1nc(Cl)cc(NS(=O)(=O)c2cc[c]cc2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.48
MAPT P10636 4/20 0.40
GAA P10253 3/20 0.40
PKM P14618 3/20 0.40
KDM4E B2RXH2 2/20 0.40
KMT2A Q03164 1/20 0.40
HSD11B1 P28845 1/20 0.40
HTR6 P50406 2/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
RAB9A P51151 1/20 0.40
APEX1 P27695 1/20 0.39
BLM P54132 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MYLK Q15746 1/20 0.38
PIK3CG P48736 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL8413208 0.86 HTR6 (0.54) L3MBTL1MAPTGAAPKMKDM4E
SCHEMBL7823473 0.85 L3MBTL1 (0.69) L3MBTL1MAPTGAAPKMKDM4E
SCHEMBL7824466 0.80 L3MBTL1 (0.53) L3MBTL1PKMKDM4EALDH1A1NPSR1
SCHEMBL8413419 0.78 HTR6 (0.51) MAPTGAAKDM4EKMT2AHSD11B1
SCHEMBL7832815 0.73 L3MBTL1 (0.74) L3MBTL1MAPTKDM4EHTR6ALDH1A1
SCHEMBL2772290 0.73 LMNA (0.52) L3MBTL1MAPTGAAKDM4EKMT2A
SCHEMBL8413230 0.72 CES1 (0.44) GAAPKMKMT2AHTR6ALDH1A1
SCHEMBL7836456 0.72 MAPT (0.60) L3MBTL1MAPTGAAPKMKDM4E
SCHEMBL7825681 0.72 HTR6 (0.57) L3MBTL1MAPTGAAPKMKDM4E
Hydrochloric Acid SCHEMBL8056250 0.72 L3MBTL1 (0.72) L3MBTL1MAPTKDM4EHTR6ALDH1A1

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
US-5939451-A INDOL-4-YL-BENZENESULFONAMIDES AS ACTIVE MATERIAL TREATING MALARIA, BACTERIAL INFECTION, NEUROLOGICAL DISORDERS HOFFMANN-LA ROCHE INC. (US) 1999-08-17 US disclosed
US-5932599-A 4-AMINO-N-(PYRIDINYL-4-YL)-BENZENESULFONAMIDES AS ACTIVE MATERIAL TREATING MALARIA, BACTERIAL INFECTION, NEUROLOGICAL DISORDERS HOFFMANN-LA ROCHE INC. (US) 1999-08-03 US disclosed