SCHEMBL10690935

SCHEMBL10690935

COC(=O)c1ccc(OC)c([Si](C)(C)C)c1OC(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
MAPK1 P28482 4/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 6/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 3/20 0.37
HSD17B10 Q99714 3/20 0.37
PTK2 Q05397 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 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
SCHEMBL10691520 0.81 ALDH1A1 (0.39) ALDH1A1MAPK1MAPTKDM4EPOLB
SCHEMBL10690737 0.76 PDE4D (0.36) ALDH1A1MAPK1MAPTPOLBKMT2A
SCHEMBL7842794 0.73 IRAK4 (0.45) ALDH1A1MAPK1MAPTKDM4EPOLB
Methyl 2,3,4-Trimethoxybenzoate SCHEMBL1434191 0.72 ALDH1A1 (0.57) ALDH1A1MAPTKDM4EPOLBHSD17B10
SCHEMBL7795902 0.72 IRAK4 (0.51) ALDH1A1MAPK1MAPTKDM4EPOLB
SCHEMBL4458299 0.72 KDM4E (0.45) ALDH1A1MAPK1MAPTKDM4EPOLB
SCHEMBL5431477 0.72 ALDH1A1 (0.53) ALDH1A1MAPTKDM4ELMNAHSD17B10
SCHEMBL6060599 0.71 ALDH1A1 (0.46) ALDH1A1MAPK1MAPTKDM4ELMNA
SCHEMBL20118893 0.70 ALDH1A1 (0.49) ALDH1A1MAPK1MAPTKDM4ELMNA
SCHEMBL27883374 0.70 MAPT (0.57) ALDH1A1MAPTKDM4EHSD17B10KMT2A

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
US-4764525-A N-1H-tetrazol-5-ylbenzamides having use as antiallergy and antiinflammatory agents WARNER-LAMBERT COMPANY (US) 1988-08-16 US disclosed