SCHEMBL11605305

SCHEMBL11605305

CCC(=O)Oc1ccc(C(=O)O)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.42
▸ ACHE P22303 2/20 0.41
▸ KMT2A Q03164 6/20 0.39
▸ KDM4E B2RXH2 5/20 0.39
▸ GAA P10253 3/20 0.39
▸ HPGD P15428 3/20 0.39
▸ GLA P06280 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ ESR1 P03372 2/20 0.38
▸ HIF1A Q16665 2/20 0.38
▸ FGFR1 P11362 1/20 0.37
▸ ELANE P08246 1/20 0.37
▸ RECQL P46063 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ USP2 O75604 1/20 0.36

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
SCHEMBL11603123 0.84 KDM4E (0.35) ALOX15KMT2AKDM4EGAAHPGD
Potassium Ion SCHEMBL11602569 0.84 ALOX15 (0.40) ALOX15ACHEKMT2AKDM4EGAA
SCHEMBL11532843 0.81 KDM4E (0.47) ACHEKMT2AKDM4EGAAHPGD
SCHEMBL14332793 0.78 KDM4E (0.53) KMT2AKDM4EGAAHPGDGLA
SCHEMBL11604724 0.77 XDH (0.42) KMT2AKDM4EHPGDHSD17B10MAPT
SCHEMBL11605400 0.77 XDH (0.43) ACHEKMT2AKDM4EGAAHPGD
SCHEMBL11607350 0.76 CNR2 (0.47) HPGDALDH1A1
SCHEMBL11591989 0.75 ALDH1A1 (0.47) KMT2AHPGDALDH1A1MEN1
SCHEMBL11607517 0.73 ALOX15 (0.43) ALOX15KMT2AKDM4EGAAGLA
SCHEMBL10292583 0.72 KDM4E (0.42) ALOX15KDM4EGAAHPGDGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4083850-A HYPOTENSIVE AGENTS MEIJI SEIKA KAISHA LTD. (JA) 1978-04-11 — — US disclosed
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