SCHEMBL7279463

SCHEMBL7279463

COc1ccc(C(=O)O)c(Cc2ccccc2)c1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 3/20 0.49
HTT P42858 2/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
PKM P14618 1/20 0.49
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
HIF1A Q16665 2/20 0.46
CYP2C9 P11712 1/20 0.46
PDE4D Q08499 4/20 0.46
CDC25B P30305 1/20 0.46
MAPK1 P28482 2/20 0.44
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HPGD P15428 2/20 0.44
APEX1 P27695 1/20 0.43
CTSV O60911 1/20 0.42

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
SCHEMBL7272682 0.87 MAPT (0.54) MAPTTDP1KDM4EPOLBGAA
SCHEMBL7948311 0.85 HNF4A (0.50) MAPTTDP1ALDH1A1HTTPDE4D
SCHEMBL28209060 0.84 PKM (0.48) MAPTTDP1ALDH1A1KDM4EHTT
SCHEMBL6307911 0.81 FAAH (0.58) ALDH1A1KDM4EHTTNPC1RAB9A
SCHEMBL27871308 0.81 ALOX5 (0.48) MAPTTDP1ALDH1A1KDM4EGAA
SCHEMBL3782773 0.81 MAPT (0.62) MAPTTDP1ALDH1A1KDM4EHTT
SCHEMBL29044998 0.80 POLB (0.49) MAPTALDH1A1KDM4EHTTPOLB
SCHEMBL7348961 0.80 MAPT (0.60) MAPTTDP1ALDH1A1KDM4EHTT
SCHEMBL3785672 0.80 MAPT (0.60) MAPTTDP1ALDH1A1KDM4EHTT
SCHEMBL982970 0.79 PDE4D (0.47) MAPTTDP1PKMNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113416297-B Ultra-high molecular weight anion exchange membrane and preparation method and application thereof 苏州大学 2022-06-24 CN disclosed
CN-113416297-A Ultra-high molecular weight anion exchange membrane and preparation method and application thereof 苏州大学 2021-09-21 CN disclosed
US-4885313-A 3,4-Dihydroxyphenylethylamine derivatives and their use FISONS PLC (GB) 1989-12-05 US disclosed
US-4803225-A Dihydroxy-phenethylamino compounds useful as pharmaceuticals FISONS, PLC (GB) 1989-02-07 US disclosed
US-4720586-A Substituted 3,4-dihydroxy-phenylethylamino compounds FISONS, PLC (GB) 1988-01-19 US disclosed
EP-0142283-A2 Phenylethylamines, process for their preparation and compositions containing them FISONS plc (GB) 1985-05-22 EP disclosed