SCHEMBL9548237

SCHEMBL9548237

O=C(/C=C/c1ccc2c(c1)OCO2)Cc1ccc(CC(=O)/C=C/c2ccc3c(c2)OCO3)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.60
▸ ALDH1A1 P00352 5/20 0.60
▸ MEN1 O00255 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ KDM4E B2RXH2 6/20 0.59
▸ TRPM8 Q7Z2W7 2/20 0.59
▸ HPGD P15428 3/20 0.58
▸ APP P05067 1/20 0.58
▸ RAB9A P51151 2/20 0.58
▸ POLB P06746 1/20 0.58
▸ CYP1A2 P05177 2/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ MAOB P27338 2/20 0.57
▸ CYP2D6 P10635 2/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ TRPV1 Q8NER1 1/20 0.56
▸ CYP1A1 P04798 1/20 0.56

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
SCHEMBL9548241 1.00 MAPT (0.60) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL17691541 0.88 MAPT (0.71) MAPTALDH1A1KDM4ETRPM8APP
SCHEMBL16576815 0.86 TRPM8 (0.68) MAPTALDH1A1KDM4ETRPM8HPGD
SCHEMBL11481924 0.84 TRPM8 (0.68) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL11481925 0.84 TRPM8 (0.68) MAPTALDH1A1MEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL27699758 0.82 TRPM8 (0.67) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL13343316 0.82 ABCG2 (0.59) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL3218729 0.81 MAPT (0.67) MAPTALDH1A1KDM4ETRPM8APP
SCHEMBL3218704 0.81 MAPT (0.67) MAPTALDH1A1KDM4ETRPM8APP
SCHEMBL2744424 0.81 MAOB (0.70) MAPTALDH1A1KDM4ETRPM8HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5193260-A — — None — — JP disclosed
JP-H05193260-A THERMAL RECORDING MATERIAL MITSUBISHI PAPER MILLS LTD 1993-08-03 — — JP disclosed
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