SCHEMBL9150847

SCHEMBL9150847

O=C(Nc1ccc(C(=O)O)c(O)c1)Oc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.64
ALDH1A1 P00352 5/20 0.64
KDM4E B2RXH2 3/20 0.64
KMT2A Q03164 3/20 0.60
PKM P14618 2/20 0.60
MAPK1 P28482 3/20 0.56
HSD17B10 Q99714 3/20 0.53
CYP2D6 P10635 3/20 0.53
POLB P06746 3/20 0.53
MEN1 O00255 2/20 0.53
ATM Q13315 1/20 0.53
CYP1A2 P05177 3/20 0.52
HPGD P15428 2/20 0.52
CYP2C19 P33261 2/20 0.52
CYP2C9 P11712 1/20 0.52
ALOX15 P16050 1/20 0.52
CASP3 P42574 1/20 0.52
RAB9A P51151 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52

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
SCHEMBL8603028 0.89 MAPT (0.78) MAPTALDH1A1KDM4EKMT2APKM
SCHEMBL8652810 0.88 MAPT (0.76) MAPTALDH1A1KDM4EKMT2APKM
SCHEMBL9148332 0.87 MAPT (0.67) MAPTALDH1A1KDM4EKMT2APKM
SCHEMBL9146244 0.87 MAPT (0.71) MAPTALDH1A1KDM4EKMT2APKM
SCHEMBL9149803 0.86 ALDH1A1 (0.58) MAPTALDH1A1KDM4EKMT2APKM
SCHEMBL9147237 0.83 KDM4E (0.61) MAPTALDH1A1KDM4EKMT2APKM
SCHEMBL8654945 0.83 KDM4E (0.60) MAPTALDH1A1KDM4EKMT2APKM
SCHEMBL8600796 0.83 ALDH1A1 (0.60) MAPTALDH1A1KDM4EKMT2APKM
SCHEMBL9150545 0.83 KDM4E (0.60) MAPTALDH1A1KDM4EKMT2APKM
SCHEMBL9149780 0.83 KDM4E (0.60) MAPTALDH1A1KDM4EKMT2APKM

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-5476957-A Dye for heat sensitive recording MITSUI TOATSU CHEMICALS, INC. (JP) 1995-12-19 US disclosed