SCHEMBL9252178

SCHEMBL9252178

CCOC(=O)c1ccc(-c2ccc(O)c(C(=O)O)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 6/20 0.62
CA12 O43570 3/20 0.58
CA1 P00915 3/20 0.58
CA2 P00918 3/20 0.58
CA7 P43166 3/20 0.58
CA9 Q16790 3/20 0.58
CA14 Q9ULX7 3/20 0.58
ACMSD Q8TDX5 4/20 0.57
DHFR P00374 1/20 0.57
HNF4A P41235 1/20 0.57
ESR1 P03372 1/20 0.54
ESR2 Q92731 1/20 0.54
HSD17B2 P37059 1/20 0.52
LCK P06239 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
MAOA P21397 1/20 0.49

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
SCHEMBL398849 0.88 CA12 (0.70) MCL1CA12CA1CA2CA7
SCHEMBL28659596 0.83 CA12 (0.63) CA12CA1CA2CA7CA9
SCHEMBL6260431 0.82 CA12 (0.64) MCL1CA12CA1CA2CA7
SCHEMBL9136311 0.82 MEN1 (0.62) MCL1CA12CA1CA2CA7
SCHEMBL30016425 0.81 CA1 (0.59) CA12CA1CA2CA7CA9
SCHEMBL31347271 0.81 CA1 (0.59) CA12CA1CA2CA7CA9
SCHEMBL6939271 0.81 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL345875 0.81 CA1 (0.59) CA12CA1CA2CA7CA9
SCHEMBL1965326 0.80 CA1 (0.73) CA12CA1CA2CA7CA9
SCHEMBL16351874 0.80 CA1 (0.73) CA12CA1CA2CA7CA9

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-0338808-B1 Alkyl salicylate resin for carbonless copy paper and imaging use SCHENECTADY INT INC (US) 1995-08-23 EP disclosed
US-5017546-A Metallized phenolic resins SCHENECTADY INTERNATIONAL, INC. 1991-05-21 US disclosed
EP-0338808-A2 Alkyl salicylate resin for carbonless copy paper and imaging use SCHENECTADY INTERNATIONAL, INC. (US) 1989-10-25 EP disclosed