SCHEMBL9851460

SCHEMBL9851460

CCOC(=O)OOC(=O)C=COOC(C)(C)c1ccc(C(C)C)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 4/20 0.34
NPC1 O15118 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HIF1A Q16665 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
EPHX1 P07099 1/20 0.32
TP53 P04637 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
KDM4E B2RXH2 2/20 0.31
ESR1 P03372 1/20 0.31
GAA P10253 1/20 0.30
ALOX15 P16050 1/20 0.30
ALOX12 P18054 1/20 0.30

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
SCHEMBL9862022 0.88 LMNA (0.34) LMNASMN1; SMN2HTTRAB9ANPC1
SCHEMBL9847991 0.87 EPHX1 (0.32) LMNASMN1; SMN2HTTCYP2D6CYP2C9
SCHEMBL9847930 0.86 CYP2D6 (0.35) CYP2D6CYP2C9HIF1AMEN1KMT2A
SCHEMBL9862043 0.86 MAPK1 (0.39) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL9847995 0.83 LMNA (0.37) LMNASMN1; SMN2HTTRAB9ANPC1
SCHEMBL4224940 0.80 CYP2D6 (0.38) LMNASMN1; SMN2HTTRAB9ANPC1
SCHEMBL8761490 0.77 CYP2D6 (0.36) LMNASMN1; SMN2HTTRAB9ANPC1
SCHEMBL5597025 0.76 ALDH1A1 (0.38) ALDH1A1
SCHEMBL10482058 0.76 MAPK1 (0.34) ALDH1A1ALOX15MAPK1
SCHEMBL8853458 0.75 CYP2D6 (0.38) SMN1; SMN2RAB9ANPC1CYP2D6CYP2C9

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
EP-0422229-A1 ADHESIVE RESIN COMPOSITION, PREPARATION THEREOF, AND LAMINATE COMPRISING SAME NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-04-17 EP disclosed