SCHEMBL7760476

SCHEMBL7760476

O=C(O)Oc1ccc2nc3cc(OC(=O)O)ccc3nc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.47
MEN1 O00255 7/20 0.47
RAB9A P51151 7/20 0.47
NPC1 O15118 6/20 0.47
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
KDM4E B2RXH2 4/20 0.47
NQO2 P16083 2/20 0.47
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.47
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
HPGD P15428 2/20 0.40
F2 P00734 1/20 0.40
GLA P06280 1/20 0.40
MAPT P10636 5/20 0.39
CA2 P00918 1/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL5265016 0.94 KMT2A (0.56) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL11084120 0.90 ALDH1A1 (0.39) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL9812280 0.89 TDP1 (0.39) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL10692489 0.89 KMT2A (0.38) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL7760052 0.83 RAB9A (0.57) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL9640851 0.81 ALDH1A1 (0.43) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL4710387 0.80 MAPT (0.54) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL809274 0.80 KMT2A (0.55) KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL11567828 0.79 ALDH1A1 (0.42) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL10583759 0.79 ALDH1A1 (0.42) KMT2ARAB9ANPC1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891182-B1 ENZYME ASSISTED DYEING OF KERATINOUS FIBRES NOVOZYMES AS (DK) 2001-11-14 EP claimed
EP-0863950-B1 HAIR DYEING COMPOSITION NOVOZYMES AS (DK) 2001-10-10 EP claimed
EP-0865465-B1 LACCASES WITH IMPROVED DYEING PROPERTIES NOVOZYMES AS (DK) 2001-05-30 EP claimed