SCHEMBL28026161

SCHEMBL28026161

CCC(=O)Oc1cccc(C)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
KMT2A Q03164 4/20 0.45
KDM4E B2RXH2 3/20 0.45
ACHE P22303 2/20 0.45
MEN1 O00255 1/20 0.45
RECQL P46063 1/20 0.45
MAPT P10636 1/20 0.45
PAX8 Q06710 1/20 0.45
PPARA Q07869 2/20 0.43
PPARG P37231 1/20 0.43
GAA P10253 2/20 0.43
TDP1 Q9NUW8 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TRPM4 Q8TD43 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL28026629 0.84 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL28213211 0.81 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL1750794 0.81 POLB (0.53) KMT2AKDM4EACHEMEN1MAPT
SCHEMBL9364224 0.81 KDM4E (0.55) CA12CA1CA2CA7CA9
SCHEMBL5404741 0.80 TDP1 (0.57) KMT2AKDM4EACHEPPARGGAA
SCHEMBL28026628 0.80 ALDH1A1 (0.45) CA12CA1CA2CA7CA9
SCHEMBL11296801 0.79 L3MBTL1 (0.51) CA12CA1CA2CA7CA9
SCHEMBL26153367 0.79 ACHE (0.47) KMT2AKDM4EACHEMEN1RECQL
SCHEMBL15549298 0.79 SMN1; SMN2 (0.51) KMT2AKDM4EACHEMEN1RECQL
SCHEMBL28309434 0.79 ACHE (0.47) KMT2AKDM4EACHEMEN1RECQL

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-104829757-B A kind of ingredient of solid catalyst of olefin polymerization acid esters compound containing bigcatkin willow and its preparation method and application 中国科学院化学研究所 2018-04-27 CN disclosed
CN-104829757-A Salicylate-compound-containing solid catalyst component for olefin polymerization, and preparation method and application thereof CHINESE ACAD INST CHEMISTRY 2015-08-12 CN disclosed