SCHEMBL6570141

SCHEMBL6570141

[NaH].[NaH].c1ccc(C2OC2c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.50
TSHR P16473 1/20 0.46
PLAU P00749 1/20 0.42
CHRM2 P08172 3/20 0.41
CHRM4 P08173 3/20 0.41
CHRM5 P08912 3/20 0.41
CHRM1 P11229 3/20 0.41
CHRM3 P20309 3/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
CYP2C19 P33261 3/20 0.39
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
KDM1A O60341 1/20 0.38
CYP2B6 P20813 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL3644410 0.97 EPHX1 (0.52) EPHX1TSHRPLAUCHRM2CHRM4
SCHEMBL12914371 0.97 EPHX1 (0.52) EPHX1TSHRPLAUCHRM2CHRM4
SCHEMBL63809 0.97 EPHX1 (0.52) EPHX1TSHRPLAUCHRM2CHRM4
SCHEMBL1103798 0.97 EPHX1 (0.52) EPHX1TSHRPLAUCHRM2CHRM4
SCHEMBL1199046 0.97 EPHX1 (0.52) EPHX1TSHRPLAUCHRM2CHRM4
SCHEMBL1199563 0.97 EPHX1 (0.52) EPHX1TSHRPLAUCHRM2CHRM4
SCHEMBL270441 0.97 EPHX1 (0.52) EPHX1TSHRPLAUCHRM2CHRM4
SCHEMBL4279301 0.93 EPHX1 (0.50) EPHX1TSHRPLAUCHRM2CHRM4
Lithium SCHEMBL29397282 0.93 EPHX1 (0.50) EPHX1TSHRPLAUCHRM2CHRM4
Hydrochloric Acid SCHEMBL28262087 0.93 EPHX1 (0.50) EPHX1TSHRPLAUCHRM2CHRM4

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
EP-0970964-B1 Method for producing a titanium complex SUMITOMO CHEMICAL CO (JP) 2004-04-21 EP disclosed
EP-0970964-A2 Method for producing titanium complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-01-12 EP disclosed