Acetophenone

Acetophenone

SCHEMBL164169

CC(=O)c1ccccc1.CC(=O)c1ccccc1OCc1ccccc1.CCCOc1ccccc1C(C)=O

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 2/20 0.55
MAOB P27338 2/20 0.54
SGMS2 Q8NHU3 2/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
L3MBTL1 Q9Y468 3/20 0.51
MAPT P10636 2/20 0.51
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
GAA P10253 1/20 0.49
HTT P42858 1/20 0.49
NPC1 O15118 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.47

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
SCHEMBL30468871 0.86 SGMS2 (0.67) LMNASMN1; SMN2ALDH1A1KDM4EMAOB
SCHEMBL71081 0.86 SGMS2 (0.67) LMNASMN1; SMN2ALDH1A1KDM4EMAOB
SCHEMBL3135517 0.84 LMNA (0.74) LMNASMN1; SMN2ALDH1A1KDM4EMEN1
Lithium SCHEMBL385607 0.83 LMNA (0.72) LMNASMN1; SMN2ALDH1A1KDM4EMEN1
SCHEMBL385606 0.83 LMNA (0.72) LMNASMN1; SMN2ALDH1A1KDM4EMEN1
SCHEMBL15887756 0.81 MEN1 (0.62) LMNASMN1; SMN2ALDH1A1KDM4EMAOB
SCHEMBL10102482 0.79 RXRA (0.68) LMNASMN1; SMN2ALDH1A1KDM4EMAOB
SCHEMBL13348916 0.78 MRGPRX4 (0.71) SMN1; SMN2MEN1KMT2ANPC1MRGPRX4
SCHEMBL11421173 0.78 ALDH1A1 (0.65) LMNASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL15922822 0.78 HTR1A (0.65) ALDH1A1KDM4EL3MBTL1MAPTTDP1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611819-A1 IRIDIUM COMPLEX AND METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND Takasago International Corporation (JP) 2013-07-10 EP disclosed
WO-2012029970-A1 IRIDIUM COMPLEX AND METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND TAKASAGO INTERNATIONAL CORPORATION (JP) 2012-03-08 WO disclosed