SCHEMBL9150545

SCHEMBL9150545

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

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.60
▸ MAPT P10636 4/20 0.60
▸ ALDH1A1 P00352 3/20 0.60
▸ HSD17B10 Q99714 3/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ CYP2D6 P10635 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ ATM Q13315 1/20 0.56
▸ PYGL P06737 1/20 0.52
▸ FAAH O00519 1/20 0.51
▸ SIRT5 Q9NXA8 2/20 0.50
▸ PKM P14618 1/20 0.50
▸ MAPK1 P28482 2/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ CASP3 P42574 1/20 0.49

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
SCHEMBL9150151 0.89 KDM4E (0.77) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL8603028 0.87 MAPT (0.78) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL8655646 0.86 KDM4E (0.60) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL8600796 0.86 ALDH1A1 (0.60) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL9149780 0.86 KDM4E (0.60) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL8654945 0.86 KDM4E (0.60) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL8652810 0.86 MAPT (0.76) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL9148332 0.85 MAPT (0.67) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL9146244 0.85 MAPT (0.71) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL9150152 0.84 MAPT (0.58) KDM4EMAPTALDH1A1HSD17B10KMT2A

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
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