SCHEMBL28575362

SCHEMBL28575362

N#Cc1cc(-c2nccc(C(=O)O)n2)ccc1OCc1cccc(Cl)c1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
XDH P47989 14/20 0.81
PTGER1 P34995 1/20 0.52

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
SCHEMBL28583385 0.89 XDH (0.81) XDH
SCHEMBL28577836 0.89 XDH (0.81) XDH
SCHEMBL28568566 0.89 XDH (0.81) XDH
SCHEMBL28583625 0.84 XDH (0.80) XDH
SCHEMBL28577408 0.82 XDH (0.75) XDH
SCHEMBL20897567 0.80 MRGPRX4 (0.64) XDH
SCHEMBL28577790 0.76 XDH (0.67) XDH
SCHEMBL28583439 0.76 XDH (0.61) XDH
SCHEMBL28582833 0.75 XDH (0.63) XDH
SCHEMBL6211864 0.75 MRGPRX4 (0.62)

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
CN-112979559-A 2-phenyl pyrimidine formic acid derivative and preparation method and application thereof 沈阳药科大学 2021-06-18 CN claimed
CN-112979559-A 2-phenyl pyrimidine formic acid derivative and preparation method and application thereof 沈阳药科大学 2021-06-18 CN disclosed