SCHEMBL7697474

SCHEMBL7697474

C=C(Cc1ccc(C)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.45
CTBP2 P56545 1/20 0.40
SMN1; SMN2 Q16637 5/20 0.40
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
CYP2C19 P33261 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
GPR119 Q8TDV5 1/20 0.37
GAA P10253 1/20 0.36
LMNA P02545 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
SCHEMBL7696588 0.85 L3MBTL1 (0.45) CTBP2SMN1; SMN2RAB9ANPC1L3MBTL1
SCHEMBL4976027 0.85 CES1 (0.44) SMN1; SMN2L3MBTL1KMT2AMEN1
SCHEMBL7690778 0.84 HTT (0.50) CTBP2SMN1; SMN2NPC1CYP2C19TDP1
SCHEMBL15322681 0.83 CHRNB2 (0.35) HPGDSMN1; SMN2RAB9ANPC1TDP1
SCHEMBL7696664 0.81 HPGD (0.45) HPGDCTBP2SMN1; SMN2RAB9ANPC1
SCHEMBL7696584 0.79 KMT2A (0.50) HPGDCTBP2SMN1; SMN2RAB9ANPC1
SCHEMBL12656602 0.79 HPGD (0.42) HPGDCTBP2SMN1; SMN2RAB9ANPC1
SCHEMBL7517689 0.79 HPGD (0.50) HPGDCTBP2RAB9ANPC1L3MBTL1
SCHEMBL28045346 0.75 KMT2A (0.40) HPGDCTBP2SMN1; SMN2RAB9ANPC1
SCHEMBL21980327 0.75 ALDH1A1 (0.51) KMT2AMEN1CYP2C19LMNA

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-6342627-B1 ESTER INTERCHANGE WITH ALCOHOL IN THE PRESENCE OF LANTHANOIDE METAL ALKOXIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-29 US disclosed