SCHEMBL9150565

SCHEMBL9150565

COC(=O)c1ccc(OC(=O)Nc2ccc(O)c(C(=O)O)c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.71
▸ MAPT P10636 5/20 0.71
▸ ALDH1A1 P00352 5/20 0.71
▸ MEN1 O00255 4/20 0.70
▸ KMT2A Q03164 4/20 0.70
▸ HSD17B10 Q99714 3/20 0.70
▸ POLB P06746 3/20 0.70
▸ ATM Q13315 2/20 0.70
▸ CYP2D6 P10635 1/20 0.70
▸ KDM4C Q9H3R0 2/20 0.53
▸ HPGD P15428 3/20 0.50
▸ GAA P10253 2/20 0.50
▸ GLA P06280 1/20 0.50
▸ CA1 P00915 2/20 0.46
▸ CA2 P00918 2/20 0.46
▸ THRB P10828 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CYP1A2 P05177 1/20 0.45
▸ NPC1 O15118 2/20 0.44

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
SCHEMBL9153922 0.88 ALDH1A1 (0.73) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL8654938 0.88 MAPT (0.77) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL8605462 0.85 ALDH1A1 (0.77) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL9149834 0.85 MAPT (0.71) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL8601506 0.84 MAPT (1.00) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL2071092 0.84 MAPT (0.70) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL8652431 0.83 KDM4E (0.77) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL9150151 0.83 KDM4E (0.77) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL9150429 0.82 MAPT (0.71) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL3989897 0.82 KDM4E (1.00) KDM4EMAPTALDH1A1MEN1KMT2A

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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