SCHEMBL29093237

SCHEMBL29093237

OCCSc1ccc2cc([SiH](c3ccccc3)c3ccccc3)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.36
EPHX2 P34913 1/20 0.36
BACE1 P56817 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA13 Q8N1Q1 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 2/20 0.34
CNR2 P34972 2/20 0.34
ALPL P05186 1/20 0.34
MAPT P10636 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
KDM4E B2RXH2 1/20 0.33
APAF1 O14727 1/20 0.33

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
SCHEMBL29093238 0.87 ALDH1A1 (0.46) EPHX2CA12CA1CA2CA7
SCHEMBL3894693 0.79 ANPEP (0.51) ANPEPBACE1CA12CA1CA2
SCHEMBL38658329 0.79 ANPEP (0.51) ANPEPBACE1CA12CA1CA2
SCHEMBL8638604 0.79 CA2 (0.48) ANPEPEPHX2BACE1CA12CA1
SCHEMBL29093234 0.75 ALDH1A1 (0.50) CA12CA1ALDH1A1MAPK1MAPT
SCHEMBL3968804 0.73 CA2 (0.47) ANPEPEPHX2BACE1CA12CA1
SCHEMBL5431321 0.73 CYP2A6 (0.41) CA1CA2CA7ALDH1A1CYP3A4
SCHEMBL30194874 0.72 ALPL (0.37) ANPEPEPHX2BACE1CA12CA1
SCHEMBL9365248 0.71 CA2 (0.46) ANPEPBACE1CA12CA1CA2
SCHEMBL7018220 0.69 CYP2A6 (0.43) ANPEPBACE1CA12CA1CA2

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
CN-115703882-B Polycarbonate resin, preparation method thereof and optical component containing resin 中国科学院过程工程研究所 2023-09-19 CN disclosed
CN-115703882-A Polycarbonate resin, preparation method thereof and optical component containing same 中国科学院过程工程研究所 2023-02-17 CN disclosed