SCHEMBL11069849

SCHEMBL11069849

CC(=O)Nc1ccc(N=Nc2ccc(N)c(S(=O)(=O)O)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.54
MAPT P10636 2/20 0.54
RAB9A P51151 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
LMNA P02545 1/20 0.54
HPGD P15428 1/20 0.54
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
PRMT3 O60678 1/20 0.50
EP300 Q09472 1/20 0.50
PRMT6 Q96LA8 1/20 0.50
PRMT1 Q99873 1/20 0.50
AMY1A P0DUB6 2/20 0.49
THRB P10828 1/20 0.47
ENPP2 Q13822 2/20 0.45
PHLPP2 Q6ZVD8 1/20 0.45
PKM P14618 1/20 0.44
CYP2C19 P33261 1/20 0.44
CA2 P00918 2/20 0.44

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
SCHEMBL66550 0.84 ENPP2 (0.60) NPC1MAPTRAB9ASMN1; SMN2ENPP2
SCHEMBL11628676 0.82 HTT (0.56) MAPTSMN1; SMN2HPGDENPP2PHLPP2
SCHEMBL11804192 0.81 ENPP2 (0.55) NPC1MAPTRAB9ASMN1; SMN2LMNA
SCHEMBL11290527 0.79 ENPP2 (0.55) NPC1MAPTRAB9ASMN1; SMN2AMY1A
SCHEMBL9477426 0.78 ENPP2 (0.51) NPC1MAPTRAB9AENPP2PHLPP2
SCHEMBL13578938 0.78 SENP2 (0.56) MAPTRAB9AHPGDTHRBPKM
SCHEMBL1436156 0.78 SENP2 (0.60) MAPTHPGDTHRBPHLPP2CYP2C19
SCHEMBL2622737 0.78 SENP2 (0.56) MAPTRAB9AHPGDTHRBPKM
SCHEMBL31099405 0.78 SENP2 (0.60) MAPTHPGDTHRBPHLPP2CYP2C19
SCHEMBL110924 0.78 SENP2 (0.60) MAPTHPGDTHRBPHLPP2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0036838-B1 AZO DYESTUFFS, THEIR PREPARATION AND THEIR USE CIBA-GEIGY AG (CH) 1984-09-26 EP disclosed
US-4447357-A Fibre-reactive azo dyestuffs containing a halotriazinyl radical and a non-reactive triazinyl radical CIBA-GEIGY CORPORATION (US) 1984-05-08 US disclosed
EP-0036838-A2 Azo dyestuffs, their preparation and their use CIBA-GEIGY AG (CH) 1981-09-30 EP disclosed
US-3960831-A WET FASTNESS, COLORFASTNESS BAYER AKTIENGESELLSCHAFT (DT) 1976-06-01 US disclosed