SCHEMBL9147173

SCHEMBL9147173

O=C(Nc1ccc(O)c(C(=O)O)c1)OCc1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 1/20 0.53
KDM4C Q9H3R0 3/20 0.50
SCD O00767 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
POLB P06746 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HSD17B10 Q99714 2/20 0.47
CYP2D6 P10635 1/20 0.47
ATM Q13315 1/20 0.47
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MGLL Q99685 1/20 0.47
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46

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
SCHEMBL9146869 0.90 PYGL (0.51) MAPTALDH1A1SCDMEN1KMT2A
SCHEMBL6883704 0.88 MAPT (0.64) MAPTKDM4EALDH1A1KDM4CPOLB
SCHEMBL9149313 0.87 ALDH1A1 (0.53) MAPTKDM4EALDH1A1KDM4CPOLB
SCHEMBL9149942 0.81 MEN1 (0.58) MAPTKDM4EALDH1A1KDM4CCA1
SCHEMBL8652431 0.80 KDM4E (0.77) MAPTKDM4EALDH1A1KDM4CCA1
SCHEMBL9148847 0.79 MAPT (0.58) MAPTKDM4EALDH1A1KDM4CCA1
SCHEMBL597309 0.78 MAPT (0.61) MAPTKDM4EALDH1A1KDM4CPOLB
SCHEMBL7842397 0.78 MGLL (0.58) MAPTKDM4EALDH1A1POLBATM
SCHEMBL3795024 0.78 POLB (0.68) MAPTALDH1A1SCDPOLBMEN1
SCHEMBL10494592 0.78 POLB (0.68) MAPTKDM4EALDH1A1POLBMEN1

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