SCHEMBL11234362

SCHEMBL11234362

CSc1ccc(O)c(SC)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.45
HSD17B10 Q99714 3/20 0.45
MEN1 O00255 2/20 0.45
HPGD P15428 2/20 0.45
KMT2A Q03164 2/20 0.45
TP53 P04637 2/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
ALOX12 P18054 1/20 0.45
ALDH1A1 P00352 2/20 0.32
PLA2G1B P04054 1/20 0.31
HSP90AA1 P07900 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
HIF1A Q16665 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31

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
SCHEMBL9986042 0.81 ALOX15 (0.43) ALOX15HSD17B10MEN1HPGDKMT2A
SCHEMBL1507626 0.81 ALOX15 (0.43) ALOX15HSD17B10MEN1HPGDKMT2A
SCHEMBL10886083 0.70 ALDH1A1 (0.40) ALOX15HSD17B10MEN1HPGDKMT2A
SCHEMBL24717063 0.70 ALOX15 (0.41) ALOX15HSD17B10MEN1HPGDKMT2A
SCHEMBL9810705 0.70 ALOX15 (0.38) ALOX15HSD17B10MEN1HPGDKMT2A
SCHEMBL10889476 0.69 ALOX15 (0.35) ALOX15HSD17B10MEN1HPGDKMT2A
SCHEMBL9985773 0.69 MEN1 (0.34) ALOX15HSD17B10MEN1HPGDKMT2A
SCHEMBL10745073 0.68 ALDH1A1 (0.32) ALOX15HSD17B10MEN1HPGDKMT2A
SCHEMBL18920781 0.68 CCR2 (0.32)
SCHEMBL10888460 0.68 MEN1 (0.35) ALOX15HSD17B10MEN1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4327018-A Azo dyes and the production and use thereof CIBA-GEIGY CORPORATION (US) 1982-04-27 US disclosed
US-4246410-A BENZINDOLE DYES OF YELLOW AND RED CIBA -GEIGY AKTIENGESELLSCHAFT (CH) 1981-01-20 US disclosed
US-4246422-A Naphtholactam dyestuffs CIBA-GEIGY AG (CH) 1981-01-20 US disclosed
US-4236007-A YELLOW SHADES ON POLYESTERS CIBA-GEIGY AKTIENGESELLSCHAFT (CH) 1980-11-25 US disclosed
US-4180665-A Substituted 3-benz(cd)indol-2-(1H)-ylidene-furo[2,3-b]quinoxalin-2(3H)one dyestuffs CIBA-GEIGY AKTIENGESELLSCHAFT (CH) 1979-12-25 US disclosed
US-4159379-A Dispersion dyestuffs of the naphtholactam series CIBA-GEIGY AG (CH) 1979-06-26 US disclosed
US-4148805-A POLYESTERS, RED, YELLLOW CIBA-GEIGY AG (CH) 1979-04-10 US disclosed
US-4146541-A YELLOW SHADE ON POLYESTERS CIBA-GEIGY AG (CH) 1979-03-27 US disclosed