SCHEMBL11329976

SCHEMBL11329976

Oc1cc(S)c2cc(Cl)ccc2c1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 6/20 0.40
TSHR P16473 4/20 0.40
CYP3A4 P08684 4/20 0.40
ALDH1A1 P00352 4/20 0.40
TDP1 Q9NUW8 1/20 0.40
HPGD P15428 5/20 0.38
ALOX15 P16050 3/20 0.38
ALOX12 P18054 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPK1 P28482 1/20 0.38
HSP90AA1 P07900 3/20 0.37
MEN1 O00255 2/20 0.36
HTT P42858 2/20 0.36
KMT2A Q03164 2/20 0.36
HIF1A Q16665 2/20 0.36
SLC22A1 O15245 1/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HSPD1 P10809 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
SCHEMBL6513110 0.69
SCHEMBL8851340 0.69
SCHEMBL17787243 0.69 HSD17B10 (0.56) HSD17B10TSHRCYP3A4ALDH1A1TDP1
SCHEMBL28744268 0.68 AHR (0.43) ALDH1A1LMNASLC2A1AHR
SCHEMBL29788814 0.68 AHR (0.43) ALDH1A1LMNASLC2A1AHR
SCHEMBL2368215 0.67 CYP3A4 (0.55) HSD17B10TSHRCYP3A4ALDH1A1MAPK1
SCHEMBL6520911 0.67 HSD17B10 (0.54) HSD17B10TSHRCYP3A4ALDH1A1TDP1
SCHEMBL6516471 0.67 HSD17B10 (0.54) HSD17B10TSHRCYP3A4ALDH1A1TDP1
SCHEMBL6520906 0.67 HSD17B10 (0.54) HSD17B10TSHRCYP3A4ALDH1A1TDP1
SCHEMBL11141475 0.67 ESR1 (0.61) HSD17B10TSHRCYP3A4ALDH1A1TDP1

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-4299966-A Process for the preparation of 4,4',7,7'-tetrachlorthioindigo in pigment form BAYER AKTIENGESELLSCHAFT (DE) 1981-11-10 US claimed
EP-0018008-A2 Process for the production of glazing-pigment forms of 4,4',7,7'-tetrachlorothio indigo BASF Aktiengesellschaft (DE) 1980-10-29 EP disclosed