SCHEMBL29638852

SCHEMBL29638852

OC1c2ccccc2C(O)c2ccccc21

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.60
MAOB P27338 1/20 0.60
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
CYP2D6 P10635 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP3A4 P08684 2/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HSD17B10 Q99714 2/20 0.40
TP53 P04637 1/20 0.40
HTR2A P28223 1/20 0.39
DYRK1A Q13627 1/20 0.39
ACP3 P15309 1/20 0.37
CYP1A2 P05177 1/20 0.36
CAMK2A Q9UQM7 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
SCHEMBL29503343 1.00 MAOA (0.60) MAOAMAOBMEN1KMT2AGAA
SCHEMBL3628239 1.00 MAOA (0.60) MAOAMAOBMEN1KMT2AGAA
SCHEMBL29884836 0.83 MAOA (0.52) MAOAMAOBMEN1KMT2ACYP2D6
SCHEMBL29376368 0.83 MAOA (0.52) MAOAMAOBMEN1KMT2ACYP2D6
SCHEMBL216862 0.83 MAOA (0.52) MAOAMAOBMEN1KMT2ACYP2D6
SCHEMBL12640638 0.81 MAOA (0.44) MAOAMAOBMEN1KMT2AGAA
SCHEMBL9799817 0.81 MAOA (0.44) MAOAMAOBMEN1KMT2AGAA
SCHEMBL24524172 0.79 EDNRA (0.43) MAOAMAOBMEN1KMT2ACYP2D6
SCHEMBL6670277 0.79 MAOA (0.43) MAOAMAOBMEN1KMT2AGAA
SCHEMBL10552630 0.79 MAOA (0.43) MAOAMAOBMEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119013316-A Method for producing polyisobutene succinic anhydride 巴斯夫欧洲公司 2024-11-22 CN disclosed
CN-119013315-A Method for producing polyisobutene succinic anhydride 巴斯夫欧洲公司 2024-11-22 CN disclosed
CN-118679194-A Medium molecular weight polyisobutenes with high content of certain double bond isomers 巴斯夫欧洲公司 2024-09-20 CN disclosed
CN-118679193-A Medium molecular weight polyisobutenes having a particular double bond isomer distribution 巴斯夫欧洲公司 2024-09-20 CN disclosed