SCHEMBL8207167

SCHEMBL8207167

CCOC(=O)c1cccc(OCC2CO2)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.59
ALDH1A1 P00352 1/20 0.59
TP53 P04637 1/20 0.59
CYP3A4 P08684 1/20 0.59
TSHR P16473 1/20 0.59
HIF1A Q16665 1/20 0.59
TDP1 Q9NUW8 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
RAB9A P51151 3/20 0.46
POLB P06746 2/20 0.46
HPGD P15428 1/20 0.46
PKM P14618 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45

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
SCHEMBL11198075 0.91 ALDH1A1 (0.64) SMN1; SMN2ALDH1A1TP53CYP3A4TSHR
SCHEMBL32684970 0.89 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1TP53CYP3A4TSHR
SCHEMBL2743575 0.87 TDP1 (0.49) SMN1; SMN2TDP1L3MBTL1RAB9APOLB
SCHEMBL13635133 0.87 SMN1; SMN2 (0.53) SMN1; SMN2TP53TDP1RAB9APOLB
SCHEMBL19876759 0.86 ALDH1A1 (0.67) SMN1; SMN2ALDH1A1TP53CYP3A4TSHR
SCHEMBL8361153 0.84 ALDH1A1 (0.55) SMN1; SMN2ALDH1A1TP53CYP3A4TSHR
SCHEMBL6915699 0.83 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1TP53CYP3A4TSHR
SCHEMBL6915703 0.83 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1TP53CYP3A4TSHR
SCHEMBL6915692 0.83 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1TP53CYP3A4TSHR
SCHEMBL8536518 0.83 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1TP53CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0747371-B1 Epoxy resins consisting of flexible chains terminated with glycidyloxyphenyl groups for use in microelectronics adhesives NAT STARCH CHEM INVEST (US) 2000-09-06 EP disclosed
US-5717054-A QUICK-SETTING NATIONAL STARCH & CHEMICAL INVESTMENT HOLDING CORP. (US) 1998-02-10 US disclosed
EP-0747371-A1 Epoxy resins consisting of flexible chains terminated with glycidyloxyphenyl groups for use in microelectronics adhesives National Starch and Chemical Investment Holding Corporation (US) 1996-12-11 EP disclosed
EP-0175325-B1 NEW 8-SUBSTITUTED NUCLEOSIDE AND PURINE DERIVATIVES, THE PROCESS FOR THE PREPARATION THEREOF AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Pierrel S.p.A. (IT) 1989-03-15 EP disclosed
US-4774325-A ANTILIPEMIC AGENTS PIERREL SPA (IT) 1988-09-27 US disclosed
EP-0175325-A2 New 8-substituted nucleoside and purine derivatives, the process for the preparation thereof and the pharmaceutical compositions containing them Pierrel S.p.A. (IT) 1986-03-26 EP disclosed