SCHEMBL9722765

SCHEMBL9722765

CC(=O)c1cc(S(=O)(=O)c2ccccc2)c(N)s1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
C1S P09871 2/20 0.49
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 5/20 0.45
HTR6 P50406 5/20 0.45
GAA P10253 2/20 0.45
PKM P14618 2/20 0.45
HPGD P15428 1/20 0.45
NPSR1 Q6W5P4 2/20 0.42
POLB P06746 1/20 0.41
GFER P55789 1/20 0.41
IKBKB O14920 1/20 0.39
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 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
SCHEMBL5348091 0.77 LMNA (0.35) ALDH1A1KDM4EGAAPKMNPSR1
SCHEMBL5840366 0.72 C1S (0.52) C1SALDH1A1KDM4EGAAPKM
SCHEMBL11638520 0.70 KMT2A (0.55) C1SALDH1A1KDM4EHTR6GAA
SCHEMBL6925255 0.69 C1S (0.73) C1S
SCHEMBL6040902 0.68 MMP2 (0.53) KDM4EHTR6GAANPSR1POLB
(Phenylsulfonyl)Benzene SCHEMBL2381369 0.68 HTR6 (0.74) ALDH1A1KDM4EHTR6GAAPKM
(Phenylsulfonyl)Benzene SCHEMBL29058880 0.68 HTR6 (0.74) ALDH1A1KDM4EHTR6GAAPKM
SCHEMBL11035205 0.68 HTR6 (0.50) ALDH1A1KDM4EHTR6GAAPKM
SCHEMBL18687495 0.68 ALDH1A1 (0.43) ALDH1A1KDM4EHTR6GAAPKM
SCHEMBL17774701 0.67 HTR6 (0.69) ALDH1A1KDM4EHTR6GAAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5120872-A Textile dyeing CIBA-GEIGY CORPORATION (US) 1992-06-09 US disclosed
US-4994563-A Dyeing, printing cellulose, silk, wool, synthetic polyamides; colorfastness CIBA-GEIGY CORPORATION (US) 1991-02-19 US disclosed
EP-0349486-A2 Azo dyes, their preparation and their use CIBA-GEIGY AG (CH) 1990-01-03 EP disclosed