SCHEMBL6287732

SCHEMBL6287732

[O]Oc1ccc2ccccc2c1-c1cccc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
DNMT1 P26358 1/20 0.46
TYMP P19971 1/20 0.41
GSK3B P49841 1/20 0.41
ADK P55263 1/20 0.41
SLC22A12 Q96S37 1/20 0.40
CYP2A6 P11509 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
DHFR P00374 1/20 0.39
WDR5 P61964 1/20 0.39
GPR84 Q9NQS5 1/20 0.39
PTPN1 P18031 1/20 0.39
CES1 P23141 1/20 0.39

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
SCHEMBL12880138 0.81 MAPT (0.75) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL7954034 0.81 MAPT (0.48) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL6908092 0.81 MAPT (0.48) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL29512056 0.81 MAPT (0.75) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL9874312 0.81 MAPT (0.48) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL9138035 0.81 GSK3B (0.48) MAPTALDH1A1MEN1RAB9AKMT2A
Bromide SCHEMBL7960862 0.80 MAPT (0.47) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL9874308 0.80 MAPT (0.47) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL9138037 0.80 GSK3B (0.47) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL30450817 0.78 GPR84 (0.43) MAPTALDH1A1MEN1RAB9AKMT2A

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
US-6867161-B1 Titanium catalyst and organotitanium reacting reagent, production thereof, and reaction thereby NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-03-15 US disclosed
EP-0820809-A1 TITANIUM CATALYST, ORGANOTITANIUM REACTION REAGENT, PROCESSES FOR PRODUCING THESE, AND METHOD OF REACTION USING THESE NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1998-01-28 EP disclosed