SCHEMBL7037895

SCHEMBL7037895

O=C(O)c1c(C(O)=S)cccc1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 1/20 0.55
FOLH1 Q04609 3/20 0.50
BCAT2 O15382 1/20 0.48
FABP3 P05413 1/20 0.46
FABP4 P15090 1/20 0.46
FABP5 Q01469 1/20 0.46
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CHRNB2 P17787 4/20 0.43
CHRNB4 P30926 4/20 0.43
CHRNA3 P32297 4/20 0.43
CHRNA4 P43681 4/20 0.43
CDC25B P30305 1/20 0.42
ATM Q13315 1/20 0.42
ALDH1A1 P00352 3/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
MYC P01106 1/20 0.41

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
SCHEMBL36146 0.86 HNF4A (0.66) HNF4AFOLH1BCAT2FABP3FABP4
SCHEMBL2018617 0.86 HNF4A (0.46) HNF4AFOLH1BCAT2FABP3FABP4
SCHEMBL29376910 0.86 HNF4A (0.66) HNF4AFOLH1BCAT2FABP3FABP4
SCHEMBL2833055 0.85 HNF4A (0.63) HNF4AFOLH1BCAT2FABP3FABP4
SCHEMBL6666734 0.85 HNF4A (0.63) HNF4AFOLH1BCAT2FABP3FABP4
Methane SCHEMBL28932446 0.85 HNF4A (0.63) HNF4AFOLH1BCAT2FABP3FABP4
Hydrochloric Acid SCHEMBL993304 0.85 HNF4A (0.63) HNF4AFOLH1BCAT2FABP3FABP4
Hydrochloric Acid SCHEMBL628183 0.85 HNF4A (0.63) HNF4AFOLH1BCAT2FABP3FABP4
SCHEMBL6662914 0.85 HNF4A (0.63) HNF4AFOLH1BCAT2FABP3FABP4
SCHEMBL6661257 0.85 HNF4A (0.63) HNF4AFOLH1BCAT2FABP3FABP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030105321-A1 Substituted with sulfonamide, sulfonate, or thiosulfonate groups of given formula; Use as a colorant and a pigment precursor, especially in light-sensitive compositions for color filters WOLLEB ANNEMARIE (CH) 2003-06-05 US disclosed
US-6444807-B1 PHOTOSENSITIVITY; COLOR FILTERS CIBA SPECIALTY CHEMICALS CORPORATION 2002-09-03 US disclosed
US-4594400-A Thioxanthonecarboxylic acids, esters thioesters and amides with reactive functional groups and polymers prepared therefrom and having thioxanthone radicals as side chains CIBA-GEIGY CORPORATION (US) 1986-06-10 US disclosed
US-4505794-A PHOTOINITIATORS WITH AMINES FOR PHOTOPOLYMERIZATION OF UNSATURATEDCOMPOUNDS; SOLUBILITY CIBA-GEIGY CORPORATION (US) 1985-03-19 US disclosed
US-4506083-A INITIATORS FOR PHOTOPOLYMERIZATION OR PHOTOCHEMICAL CROSSLINKING CIBA-GEIGY CORPORATION (US) 1985-03-19 US disclosed
US-4367324-A Photocrosslinkable polymers with thioxanthone and imidyl groupings in side chains CIBA-GEIGY CORPORATION (US) 1983-01-04 US disclosed
US-4348530-A Thioxanthonecarboxylic acids, esters, thioesters and amides with reactive functional groups CIBA-GEIGY CORPORATION (US) 1982-09-07 US disclosed