SCHEMBL5014098

SCHEMBL5014098

C=Cc1ccccc1COc1ccccc1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
HTT P42858 2/20 0.55
TP53 P04637 1/20 0.55
KMT2A Q03164 2/20 0.50
PTK2B Q14289 1/20 0.50
FOLH1 Q04609 2/20 0.49
KDM4E B2RXH2 4/20 0.49
MRGPRX4 Q96LA9 1/20 0.47
APEX1 P27695 1/20 0.46
NPC1 O15118 1/20 0.45
MEN1 O00255 1/20 0.45
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
MAPT P10636 1/20 0.44
CLCN2 P51788 1/20 0.41
ESR1 P03372 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
HMGB1 P09429 1/20 0.41
TSHR P16473 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
SCHEMBL4578212 0.89 FOLH1 (0.56) ALDH1A1HTTTP53KMT2APTK2B
SCHEMBL14397907 0.82 ALDH1A1 (0.62) ALDH1A1HTTTP53KMT2APTK2B
SCHEMBL26639282 0.79 ALDH1A1 (0.71) ALDH1A1HTTTP53KMT2APTK2B
SCHEMBL11055202 0.78 ALDH1A1 (0.59) ALDH1A1HTTKMT2AKDM4EHPGD
SCHEMBL38459 0.78 ALDH1A1 (0.69) ALDH1A1HTTTP53KMT2APTK2B
SCHEMBL31482063 0.78 HTT (0.64) ALDH1A1HTTTP53KMT2APTK2B
SCHEMBL1388012 0.77 ALDH1A1 (0.68) ALDH1A1HTTTP53KMT2APTK2B
SCHEMBL31070742 0.77 ALDH1A1 (1.00) ALDH1A1HTTTP53KMT2APTK2B
SCHEMBL6447237 0.77 ALDH1A1 (0.68) ALDH1A1HTTTP53KMT2APTK2B
SCHEMBL2451525 0.77 ALDH1A1 (0.68) ALDH1A1HTTTP53KMT2APTK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3075751-B1 POLYMER CONTAINING CARBOXYL GROUP AND USE THEREOF ASYMCHEM LAB TIANJIN CO LTD (CN) 2019-10-23 EP disclosed
US-8283413-B2 ink-jet ink; improved stability and dispersibility; polymerized hydrophobic acid-functionalized monomer includes 2-(benzyloxycarbonylmethyl)acrylic acid HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2012-10-09 US disclosed
US-20080182934-A1 Acid-functionalized hydrophobic monomer emulsions, latexes, and associated latexes HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2008-07-31 US disclosed