SCHEMBL11856166

SCHEMBL11856166

Cc1cc(OCC(=O)O)cc(=O)o1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.55
ALDH1A1 P00352 6/20 0.55
HPGD P15428 5/20 0.55
HSD17B10 Q99714 4/20 0.47
PTPRB P23467 1/20 0.47
MAPT P10636 2/20 0.45
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MCL1 Q07820 1/20 0.45
AGER Q15109 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
GLA P06280 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44
LMNA P02545 1/20 0.44
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
CA1 P00915 1/20 0.42

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
SCHEMBL7964491 0.80 KDM4E (0.60) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL8677199 0.75 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL7469324 0.75 ALDH1A1 (0.51) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL28645298 0.74 ALOX15 (0.65) ALDH1A1HPGDHSD17B10PTPRBMAPT
SCHEMBL7457655 0.74 CA1 (0.51) KDM4EALDH1A1HPGDMAPTPOLB
SCHEMBL7461497 0.74 ALDH1A1 (0.46) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL7463651 0.74 ALDH1A1 (0.46) KDM4EALDH1A1HPGDMAPTPOLB
SCHEMBL5387851 0.74 LMNA (0.56) HPGDHSD17B10PTPRBPOLBMCL1
SCHEMBL1613109 0.74 HPGD (0.56) ALDH1A1HPGDHSD17B10PTPRBMAPT
SCHEMBL9901826 0.73 KDM4E (0.54) KDM4EALDH1A1HPGDHSD17B10MAPT

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-3969323-A Photo-crosslinkable 2-pyrone polymers and processes for the manufacture thereof HOECHST AKTIENGESELLSCHAFT (DT) 1976-07-13 US disclosed