SCHEMBL9714060

SCHEMBL9714060

Cc1cc(NC(C)C)ccc1S(=O)(=O)c1ccc(N)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.47
PKM P14618 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.43
HTR6 P50406 4/20 0.42
LMNA P02545 2/20 0.42
CYP3A4 P08684 2/20 0.42
MPO P05164 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 7/20 0.41
MAPT P10636 4/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ABCC9 O60706 1/20 0.41
ABCC8 Q09428 1/20 0.41
KCNJ11 Q14654 1/20 0.41
KCNJ8 Q15842 1/20 0.41
HKDC1 Q2TB90 1/20 0.40
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38

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
SCHEMBL9714094 0.84 HSD11B1 (0.48) CYP2C19PKML3MBTL1HTR6LMNA
SCHEMBL9713975 0.84 HTR6 (0.50) CYP2C19PKML3MBTL1HTR6LMNA
SCHEMBL9713847 0.82 KMT2A (0.50) L3MBTL1LMNACYP3A4ALDH1A1KDM4E
SCHEMBL9713906 0.80 L3MBTL1 (0.43) CYP2C19PKML3MBTL1HTR6LMNA
SCHEMBL7195431 0.80 L3MBTL1 (0.63) CYP2C19PKML3MBTL1HTR6LMNA
SCHEMBL9713815 0.79 CNR1 (0.41) CYP2C19PKML3MBTL1HTR6LMNA
SCHEMBL9577459 0.78 CA1 (0.47) CYP2C19PKML3MBTL1HTR6LMNA
SCHEMBL9713891 0.78 CNR2 (0.43) CYP2C19PKMLMNACYP3A4TSHR
SCHEMBL11590652 0.77 HTR6 (0.52) PKML3MBTL1HTR6LMNACYP3A4
SCHEMBL10716571 0.76 ATM (0.58) CYP2C19PKML3MBTL1CYP3A4CYP2C9

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5084449-A Bactericides and antiprotozoa agents DR. KARL THOMAE GMBH (DE) 1992-01-28 US disclosed
US-4992430-A Anti-bacterial compositions comprising a substituted bis-(4-aminophenyl)-sulfone and a dihydro-folic acid reductase DR. KARL THOMAE GMBH (DE) 1991-02-12 US disclosed
US-4829058-A INHIBITORS OF BACTERIA, MYCOBACTERIA AND PLASMODIA DR. KARL THOMAE GMBH (DE) 1989-05-09 US disclosed
EP-0165422-B1 SUBSTITUTED BIS-(4-AMINOPHENYL)-SULPHONES, THEIR PREPARATION AND THEIR USE AS MEDICINES Dr. Karl Thomae GmbH (DE) 1988-03-09 EP disclosed
EP-0165422-A1 Substituted bis-(4-aminophenyl)-sulphones, their preparation and their use as medicines Dr. Karl Thomae GmbH (DE) 1985-12-27 EP disclosed