SCHEMBL28575487

SCHEMBL28575487

CC(=O)Nc1cccc([Si](C)(C)C)c1/C=C\[Si](C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
HPGD P15428 3/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAOA P21397 1/20 0.37
CYP2C19 P33261 2/20 0.36
POLB P06746 1/20 0.36
KDM4E B2RXH2 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CASP6 P55212 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
TSHR P16473 2/20 0.35

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
SCHEMBL28575488 1.00 ALDH1A1 (0.40) ALDH1A1HPGDMEN1KMT2AMAOA
SCHEMBL8882495 0.70 ALDH1A1 (0.53) ALDH1A1HPGDMEN1KMT2AMAOA
SCHEMBL28568650 0.69 NFE2L2 (0.37) HPGDCYP2C19POLBKDM4ECYP1A2
SCHEMBL28568651 0.69 NFE2L2 (0.37) HPGDCYP2C19POLBKDM4ECYP1A2
SCHEMBL13812018 0.68 CYP2C19 (0.49) ALDH1A1HPGDMEN1KMT2AMAOA
SCHEMBL28568739 0.67 CYP1A1 (0.40) ALDH1A1HPGDMEN1KMT2AKDM4E
SCHEMBL28568741 0.67 CYP1A1 (0.40) ALDH1A1HPGDMEN1KMT2AKDM4E
SCHEMBL11012380 0.65 ALDH1A1 (0.47) ALDH1A1HPGDMEN1KMT2AMAOA
SCHEMBL6689158 0.65 ALDH1A1 (0.74) ALDH1A1HPGDMEN1KMT2AMAOA
SCHEMBL5559272 0.64 ALDH1A1 (0.46) ALDH1A1HPGDMEN1KMT2AMAOA

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
CN-109021003-B Preparation method of vinyl silicon/germanium/stannane derivative 华侨大学 2021-06-01 CN disclosed