SCHEMBL29705659

SCHEMBL29705659

OCC[C@H](CO)Oc1cccc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OGG1 O15527 1/20 0.44
SLC6A4 P31645 1/20 0.43
WDR5 P61964 1/20 0.41
KMT2A Q03164 2/20 0.41
CYP2D6 P10635 1/20 0.41
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
FKBP1A P62942 1/20 0.40
KDM4E B2RXH2 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAOB P27338 1/20 0.37
AOC3 Q16853 1/20 0.37

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
SCHEMBL29705631 1.00 OGG1 (0.44) OGG1SLC6A4WDR5KMT2ACYP2D6
SCHEMBL23164157 1.00 OGG1 (0.44) OGG1SLC6A4WDR5KMT2ACYP2D6
SCHEMBL28749488 1.00 OGG1 (0.44) OGG1SLC6A4WDR5KMT2ACYP2D6
SCHEMBL23164155 1.00 OGG1 (0.44) OGG1SLC6A4WDR5KMT2ACYP2D6
SCHEMBL29705671 0.90 OGG1 (0.42) OGG1SLC6A4WDR5KMT2ACYP2D6
SCHEMBL23164152 0.90 OGG1 (0.42) OGG1SLC6A4WDR5KMT2ACYP2D6
SCHEMBL23164153 0.90 OGG1 (0.42) OGG1SLC6A4WDR5KMT2ACYP2D6
SCHEMBL29705705 0.90 OGG1 (0.42) OGG1SLC6A4WDR5KMT2ACYP2D6
SCHEMBL23164171 0.90 OGG1 (0.42) OGG1SLC6A4WDR5KMT2ACYP2D6
SCHEMBL23164166 0.80 MAOB (0.41) KMT2AKDM4EALDH1A1MAPTLMNA

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
CN-114555573-A Prostaglandin E2(PGE2)EP4Receptor antagonists 多曼治疗学公司 2022-05-27 CN disclosed