SCHEMBL7973277

SCHEMBL7973277

CCCCC=Cc1cc(OC)c(OC)cc1C=CC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.48
PDE5A O76074 1/20 0.48
ALDH1A1 P00352 5/20 0.47
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HSD17B10 Q99714 2/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
NFE2L2 Q16236 1/20 0.46
PTGER4 P35408 1/20 0.46
PTGER2 P43116 1/20 0.46
PKM P14618 2/20 0.44
LTA4H P09960 1/20 0.44
HTR1A P08908 1/20 0.44
HTR2C P28335 1/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
PTGER3 P43115 1/20 0.44
CA12 O43570 2/20 0.42
CA1 P00915 2/20 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
SCHEMBL17821858 0.77 NFE2L2 (0.53) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL17821859 0.77 NFE2L2 (0.53) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL17864832 0.77 KDM4E (0.54) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL5882934 0.77 NFE2L2 (0.56) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL5882941 0.77 NFE2L2 (0.56) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL715804 0.76 NFE2L2 (0.76) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL715805 0.76 NFE2L2 (0.76) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL30871940 0.76 NFE2L2 (0.76) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL8086133 0.76 CA12 (0.51) PDE5AALDH1A1HPGDMAPK1PKM
SCHEMBL8086134 0.76 CA12 (0.51) PDE5AALDH1A1HPGDMAPK1PKM

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-6277502-B1 ORGANOSILICON POLYMERS; LIQUID CRYSALS ROLIC AG (CH) 2001-08-21 US disclosed