SCHEMBL11427835

SCHEMBL11427835

Cc1ccc(C(=O)Nc2ccc3c(O)c(S(=O)(=O)O)ccc3c2)cc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 1/20 0.49
▸ CTDSP1 Q9GZU7 1/20 0.49
▸ ENPP2 Q13822 7/20 0.46
▸ TNIK Q9UKE5 1/20 0.43
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ NT5E P21589 1/20 0.40
▸ MAPT P10636 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ ENPP3 O14638 1/20 0.40
▸ ENTPD3 O75355 1/20 0.40
▸ NR1I2 O75469 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ PRKD3 O94806 1/20 0.40
▸ TDP2 O95551 1/20 0.40
▸ CBX7 O95931 1/20 0.40
▸ NSD2 O96028 1/20 0.40
▸ ESR1 P03372 1/20 0.40

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
SCHEMBL11435442 0.91 CASP6 (0.49) CASP6CTDSP1ENPP2NPC1RAB9A
SCHEMBL11427748 0.85 CASP6 (0.47) CASP6CTDSP1ENPP2NPC1RAB9A
SCHEMBL11433010 0.85 CASP6 (0.67) CASP6CTDSP1ENPP2NPC1RAB9A
SCHEMBL11441385 0.84 ENPP2 (0.51) CASP6CTDSP1ENPP2TNIKNPC1
SCHEMBL11435634 0.84 ENPP2 (0.47) CASP6CTDSP1ENPP2TNIKNPC1
SCHEMBL10907894 0.83 ENPP2 (0.45) CASP6CTDSP1ENPP2NPC1RAB9A
SCHEMBL11342360 0.83 HPSE (0.48) CASP6CTDSP1ENPP2NPC1RAB9A
SCHEMBL11208054 0.83 CASP6 (0.62) CASP6CTDSP1ENPP2TNIKNPC1
SCHEMBL11433700 0.83 MAPT (0.55) CTDSP1NPC1RAB9AMAPTKMT2A
SCHEMBL11426163 0.82 CASP6 (0.73) CASP6CTDSP1ENPP2TNIKNT5E

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-4216165-A Amine precursors to ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 — — US disclosed
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