SCHEMBL14133403

SCHEMBL14133403

CC(=O)Nc1ccc(/N=N/c2c(N)ccc3cc(C)cc(O)c23)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.52
▸ MAPT P10636 3/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ NFKB2 Q00653 1/20 0.49
▸ RELA Q04206 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ENPP2 Q13822 2/20 0.43
▸ AMY1A P0DUB6 3/20 0.43
▸ SUMO2 P61956 1/20 0.43
▸ SUMO1 P63165 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP2 Q9HC62 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ PRMT3 O60678 1/20 0.40
▸ EP300 Q09472 1/20 0.40
▸ PRMT6 Q96LA8 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
SCHEMBL13411278 0.85 ENPP2 (0.61) THRBMAPTRAB9ANPC1LMNA
SCHEMBL15113011 0.81 ENPP2 (0.68) THRBENPP2AMY1ASUMO2SUMO1
SCHEMBL14132850 0.81 ENPP2 (0.47) THRBMAPTRAB9ANPC1LMNA
SCHEMBL13998592 0.80 SUMO2 (0.44) THRBMAPTRAB9ANPC1LMNA
SCHEMBL14133646 0.76 SUMO2 (0.38) THRBMAPTHPGDENPP2SUMO2
SCHEMBL11911475 0.75 MAPT (0.58) THRBMAPTRAB9ANPC1LMNA
SCHEMBL13181261 0.74 ENPP2 (0.49) THRBMAPTRAB9ANPC1LMNA
SCHEMBL11311133 0.72 ENPP2 (0.58) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL12994564 0.71 ENPP2 (0.82) ENPP2AMY1ASUMO2SUMO1SENP7
SCHEMBL18405965 0.71 TDP1 (0.77) THRBMAPTRAB9ANPC1LMNA

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-8323358-B2 Acid dye mixture DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2012-12-04 — — US disclosed
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