SCHEMBL9847995

SCHEMBL9847995

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

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 1/20 0.36
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HIF1A Q16665 1/20 0.33
RAB9A P51151 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
EPHX1 P07099 1/20 0.31
HPGD P15428 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KIF11 P52732 1/20 0.31

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
SCHEMBL9862104 0.87 EPHX1 (0.31) LMNACYP2D6CYP2C9HIF1AEPHX1
SCHEMBL9848006 0.86 CYP2D6 (0.34) CYP2D6CYP2C9HIF1AMEN1KMT2A
SCHEMBL9851460 0.83 LMNA (0.37) LMNASMN1; SMN2HTTCYP2D6CYP2C9
SCHEMBL9861992 0.78 MAPK1 (0.33) MEN1KMT2AALDH1A1
SCHEMBL5595915 0.76 ALDH1A1 (0.36) LMNAALDH1A1
Propane SCHEMBL10714983 0.76 MAPK1 (0.36) SMN1; SMN2ALDH1A1
SCHEMBL9847989 0.75 LMNA (0.38) LMNASMN1; SMN2HTTCYP2D6CYP2C9
SCHEMBL9862022 0.74 LMNA (0.34) LMNASMN1; SMN2HTTCYP2D6CYP2C9
SCHEMBL10497538 0.74 MAPK1 (0.38) SMN1; SMN2HTTCYP2D6MEN1KMT2A
SCHEMBL9847948 0.74 ALDH1A1 (0.34) ALDH1A1

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