SCHEMBL9713635

SCHEMBL9713635

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
HTR6 P50406 4/20 0.46
CYP3A4 P08684 2/20 0.46
ALOX15 P16050 2/20 0.46
TP53 P04637 1/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 1/20 0.46
MPO P05164 1/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 2/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPT P10636 1/20 0.41
PKM P14618 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HKDC1 Q2TB90 1/20 0.39

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
SCHEMBL9713845 0.84 HTR6 (0.46) ALDH1A1HTR6CYP3A4ALOX15TP53
SCHEMBL7195431 0.83 L3MBTL1 (0.63) ALDH1A1HTR6CYP3A4TDP1LMNA
SCHEMBL9713947 0.81 MAPT (0.53) ALDH1A1CYP3A4ALOX15MAPK1TDP1
SCHEMBL11590652 0.80 HTR6 (0.52) ALDH1A1HTR6CYP3A4LMNAMPO
SCHEMBL9713990 0.76 HTR6 (0.50) ALDH1A1HTR6CYP3A4TDP1LMNA
SCHEMBL9713975 0.75 HTR6 (0.50) ALDH1A1HTR6CYP3A4LMNAMPO
SCHEMBL11534531 0.75 MAPT (0.47) ALDH1A1ALOX15MAPK1TDP1LMNA
SCHEMBL21378334 0.74 HTR6 (0.53) ALDH1A1HTR6CYP3A4ALOX15TP53
SCHEMBL30543085 0.74 HTR6 (0.53) ALDH1A1HTR6CYP3A4ALOX15TP53
SCHEMBL5554575 0.73 L3MBTL1 (0.59) ALDH1A1HTR6CYP3A4LMNAMPO

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