SCHEMBL28523658

SCHEMBL28523658

CC(C)(C)[Si](C)(C)OCCCN1CCCC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUT P33316 1/20 0.46
PIK3CD O00329 1/20 0.39
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PGK1 P00558 1/20 0.38
PDK2 Q15119 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.37
ADRA1B P35368 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TSHR P16473 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 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
SCHEMBL1632352 0.96 DUT (0.45) DUTPIK3CDKMT2AKDM4EALDH1A1
SCHEMBL21389245 0.91 KMT2A (0.42) DUTPIK3CDKMT2APDK2MEN1
SCHEMBL7508712 0.87 KMT2A (0.38) DUTPIK3CDKMT2APDK2SMN1; SMN2
SCHEMBL8865301 0.87 DUT (0.44) DUTKDM4EALDH1A1GLAGAA
SCHEMBL9764243 0.81 DUT (0.40) DUTKMT2AGAASMN1; SMN2MEN1
SCHEMBL6449914 0.81 PIK3CD (0.43) PIK3CDKMT2AALDH1A1TSHR
SCHEMBL28437904 0.79 DUT (0.46) DUT
SCHEMBL6161985 0.79 DUT (0.43) DUT
SCHEMBL9739420 0.77 PIK3CD (0.39) DUTPIK3CDKMT2AALDH1A1L3MBTL1
SCHEMBL1633091 0.77 DUT (0.41) DUT

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-112236161-A Modulators of G protein-coupled receptors 卡莫特治疗学股份有限公司 2021-01-15 CN disclosed