SCHEMBL11047695

SCHEMBL11047695

CC(OC(=O)CCCC(=O)OC(C)c1ccco1)c1ccco1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.41
KMT2A Q03164 5/20 0.41
POLB P06746 3/20 0.41
PKM P14618 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPN7 P35236 1/20 0.41
BLM P54132 1/20 0.41
ESR2 Q92731 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 4/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HPGD P15428 3/20 0.38
AGTR1 P30556 1/20 0.38
ATM Q13315 1/20 0.37
CYP2C19 P33261 2/20 0.37
MIF P14174 1/20 0.36
GLA P06280 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
SCHEMBL11047691 0.94 KMT2A (0.40) ALOX5KMT2APOLBPKMPTPN1
SCHEMBL28453165 0.87 ALDH1A1 (0.41) ALOX5KMT2APOLBPKMPTPN1
SCHEMBL30322580 0.85 ALOX5 (0.42) ALOX5KMT2APOLBPKMPTPN1
SCHEMBL14073828 0.83 ALOX5 (0.41) ALOX5KMT2APOLBPKMPTPN1
Tetrahydrofuran SCHEMBL28992325 0.79 HPGD (0.38) ALOX5KMT2APOLBPKMPTPN1
SCHEMBL1258862 0.77 ALOX5 (0.53) ALOX5KMT2APOLBPKMPTPN1
SCHEMBL27828379 0.76 LMNA (0.47) ALOX5KMT2APOLBPKMPTPN1
SCHEMBL28089140 0.76 HCAR2 (0.51) ALOX5KMT2APOLBPKMPTPN1
SCHEMBL29220006 0.75 KMT2A (0.41) KMT2APOLBPKMPTPN1PTPN7
SCHEMBL7108625 0.75 NPC1 (0.44) ALOX5KMT2APOLBPKMPTPN1

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-4478962-A WITH ACID CURABLE FURFURYL ALCOHOL PREPOLYMERS CL INDUSTRIES, INC. (US) 1984-10-23 US disclosed