SCHEMBL7722382

SCHEMBL7722382

O=C(c1ccccc1)c1ccc(SCSc2ccc(C(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
SRD5A2 P31213 2/20 0.56
ATM Q13315 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NPY5R Q15761 1/20 0.49
RAB9A P51151 6/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
MAPK13 O15264 1/20 0.48
MAPK12 P53778 1/20 0.48
MAPK11 Q15759 1/20 0.48
MAPK14 Q16539 1/20 0.48
NPC1 O15118 4/20 0.47
HPGD P15428 3/20 0.47
FFAR1 O14842 1/20 0.47
GAA P10253 1/20 0.46
ELANE P08246 1/20 0.46

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
SCHEMBL11306067 0.88 ALDH1A1 (0.58) ALDH1A1SRD5A2ATMTDP1L3MBTL1
SCHEMBL11356807 0.84 ALDH1A1 (0.54) ALDH1A1SRD5A2ATMTDP1L3MBTL1
SCHEMBL27910293 0.84 ALDH1A1 (0.54) ALDH1A1SRD5A2ATMTDP1L3MBTL1
SCHEMBL15007027 0.84 FFAR1 (0.70) ALDH1A1SRD5A2ATMTDP1L3MBTL1
SCHEMBL51274 0.82 GAA (0.54) ALDH1A1SRD5A2ATMTDP1L3MBTL1
SCHEMBL5315574 0.82 HAO1 (0.59) ALDH1A1SRD5A2RAB9AMEN1KMT2A
SCHEMBL15006838 0.81 HDAC1 (0.62) ALDH1A1SRD5A2RAB9AMEN1KMT2A
SCHEMBL11299425 0.81 ALDH1A1 (0.50) ALDH1A1SRD5A2ATMTDP1L3MBTL1
SCHEMBL7077503 0.81 ALDH1A1 (0.58) ALDH1A1SRD5A2L3MBTL1NPY5RRAB9A
SCHEMBL17828245 0.80 ALDH1A1 (0.67) ALDH1A1SRD5A2ATMTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6395446-B1 CONTAINING SULFONYLDIAZOMETHANE COMPOUND AS ACID GENERATOR SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-05-28 US disclosed