SCHEMBL10585260

SCHEMBL10585260

O=C(Nc1ccc2c(O)cc(S(=O)(=O)O)cc2c1S(=O)(=O)O)c1ccc2nc(Cl)c(Cl)nc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 1/20 0.46
▸ CTDSP1 Q9GZU7 1/20 0.46
▸ PRMT1 Q99873 2/20 0.42
▸ APEX1 P27695 1/20 0.41
▸ TIMP3 P35625 4/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ USP2 O75604 2/20 0.38
▸ RECQL P46063 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ ENPP3 O14638 1/20 0.38
▸ ENTPD3 O75355 1/20 0.38
▸ NR1I2 O75469 1/20 0.38
▸ PRKD3 O94806 1/20 0.38
▸ TDP2 O95551 1/20 0.38
▸ CBX7 O95931 1/20 0.38
▸ NSD2 O96028 1/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ PRKCG P05129 1/20 0.38

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
SCHEMBL10582151 0.81 NT5E (0.58) CASP6CTDSP1PRMT1APEX1MEN1
SCHEMBL7901329 0.79 APEX1 (0.60) CASP6CTDSP1PRMT1APEX1TIMP3
SCHEMBL1803722 0.74 CASP6 (0.52) CASP6CTDSP1PRMT1KMT2ANSD2
SCHEMBL11593186 0.72 CDH1 (0.40) CASP6CTDSP1PRMT1MEN1KMT2A
SCHEMBL10583752 0.71 L3MBTL1 (0.47) APEX1MEN1USP2RECQLKMT2A
SCHEMBL10509094 0.71 PRMT1 (0.48) CASP6CTDSP1PRMT1MEN1RECQL
SCHEMBL9799497 0.70 CASP6 (0.60) CASP6CTDSP1PRMT1APEX1TIMP3
SCHEMBL11036814 0.70 PRMT1 (0.48) CASP6CTDSP1PRMT1APEX1TIMP3
SCHEMBL9696584 0.70 PRMT1 (0.48) CASP6CTDSP1PRMT1APEX1TIMP3
SCHEMBL5720482 0.68 CYP1A2 (0.47) CASP6CTDSP1PRMT1RECQLHSD17B10

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-4841030-A Azo reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1989-06-20 — — US disclosed
US-4089895-A COUPLER FOR AZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1978-05-16 — — US disclosed
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