SCHEMBL28062826

SCHEMBL28062826

CO[Si](C)(OC)c1cccc(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
NOTUM Q6P988 2/20 0.41
RELA Q04206 2/20 0.37
TSHR P16473 4/20 0.37
NPC1 O15118 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPT P10636 2/20 0.36
TP53 P04637 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
GAA P10253 1/20 0.35
CYP3A4 P08684 1/20 0.34
IDO1 P14902 1/20 0.34
AGXT P21549 1/20 0.34
NR1I3 Q14994 1/20 0.34
MPO P05164 1/20 0.34
EGFR P00533 1/20 0.34

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
SCHEMBL17937743 0.85 NOTUM (0.39) ALDH1A1NOTUMRELATSHRMAPT
SCHEMBL2864359 0.84 ACHE (0.31) ALDH1A1NOTUMCYP3A4
SCHEMBL17937774 0.83 NOTUM (0.41) ALDH1A1NOTUMRELATSHRNPC1
SCHEMBL28062714 0.79 CYP3A4 (0.35) ALDH1A1NOTUMTSHRSMN1; SMN2MAPT
SCHEMBL3889788 0.78 TSHR (0.42) ALDH1A1NOTUMRELATSHRNPC1
SCHEMBL9486124 0.78 TSHR (0.42) ALDH1A1NOTUMRELATSHRNPC1
SCHEMBL387599 0.77 ACHE (0.46) ALDH1A1RELATSHRNPC1SMN1; SMN2
SCHEMBL28062861 0.76 KMT2A (0.39) ALDH1A1NOTUMMAPTTP53MEN1
SCHEMBL21196889 0.76 TSHR (0.41) ALDH1A1NOTUMRELATSHRNPC1
SCHEMBL22318993 0.76 TSHR (0.41) ALDH1A1NOTUMRELATSHRNPC1

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-105555901-A Polishing composition FUJIMI INC 2016-05-04 CN disclosed