SCHEMBL10388956

SCHEMBL10388956

Nc1cc(S(=O)(=O)Nc2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)ccc1S(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ CASP6 P55212 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ MEN1 O00255 5/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ SLC16A3 O15427 3/20 0.44
▸ TDP1 Q9NUW8 2/20 0.43
▸ GLO1 Q04760 1/20 0.43
▸ PGAM1 P18669 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ ATM Q13315 1/20 0.41
▸ F2 P00734 1/20 0.41
▸ PRSS1 P07477 1/20 0.41
▸ PRSS2 P07478 1/20 0.41
▸ PRSS3 P35030 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ LMNA P02545 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
SCHEMBL10389342 0.87 KMT2A (0.58) PLAUALDH1A1MEN1KMT2ATDP1
SCHEMBL10389258 0.87 ALDH1A1 (0.54) ALDH1A1CYP2C9CYP2C19CASP6HSD17B10
SCHEMBL10389247 0.84 PLAU (0.45) PLAUALDH1A1MEN1KMT2ASLC16A3
SCHEMBL10389286 0.81 PLAU (0.43) PLAUALDH1A1CYP2C9CYP2C19HSD17B10
SCHEMBL9806959 0.75 HSP90AA1 (0.47) ALDH1A1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL10389380 0.75 LMNA (0.69) ALDH1A1CYP2C9CYP2C19HSD17B10MEN1
SCHEMBL10390202 0.72 LMNA (0.50) ALDH1A1CYP2C9CYP2C19CASP6HSD17B10
SCHEMBL10388572 0.72 GPR27 (0.54) ALDH1A1MEN1KMT2ATDP1HDAC1
SCHEMBL10388565 0.71 CYP2C19 (0.48) ALDH1A1CYP2C9CYP2C19CASP6HSD17B10
SCHEMBL9806976 0.71 PGR (0.48) ALDH1A1MEN1KMT2AHDAC1GAA

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-4918183-A Monoazo dyes, process for their preparation, and the use thereof CIBA-GEIGY CORPORATION (US) 1990-04-17 — — US disclosed
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