SCHEMBL2018456

SCHEMBL2018456

CC(C)[Si](O)(c1ccc(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.43
APP P05067 2/20 0.41
CTDSP1 Q9GZU7 1/20 0.38
AHR P35869 1/20 0.38
TRPM8 Q7Z2W7 3/20 0.38
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 2/20 0.36
MAPK1 P28482 2/20 0.36
KMT2A Q03164 2/20 0.36
USP2 O75604 1/20 0.36
CTNNB1 P35222 1/20 0.36
ATM Q13315 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
PTGS1 P23219 1/20 0.36
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 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
SCHEMBL2018454 1.00 RELA (0.43) RELAAPPCTDSP1AHRTRPM8
SCHEMBL2017341 0.82 APP (0.55) RELAAPPALDH1A1MAPTMEN1
SCHEMBL2017340 0.82 APP (0.55) RELAAPPALDH1A1MAPTMEN1
SCHEMBL806444 0.77 RELA (0.60) RELAAPPCTDSP1TRPM8ALDH1A1
SCHEMBL21922852 0.77 RELA (0.60) RELAAPPCTDSP1TRPM8ALDH1A1
SCHEMBL14526617 0.77 RELA (0.60) RELAAPPCTDSP1TRPM8ALDH1A1
SCHEMBL275802 0.77 RELA (0.60) RELAAPPCTDSP1TRPM8ALDH1A1
SCHEMBL101911 0.77 RELA (0.60) RELAAPPCTDSP1TRPM8ALDH1A1
SCHEMBL275803 0.77 RELA (0.60) RELAAPPCTDSP1TRPM8ALDH1A1
SCHEMBL14018370 0.77 RELA (0.60) RELAAPPCTDSP1TRPM8ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2341108-B1 Surface treatment method for solid material SHINETSU CHEMICAL CO (JP) 2014-07-02 EP disclosed
US-8541631-B2 Surface treatment method for solid material SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-09-24 US disclosed
EP-2341108-A1 Surface treatment method for solid material Shin-Etsu Chemical Co., Ltd. (JP) 2011-07-06 EP disclosed
US-20110160464-A1 SURFACE TREATMENT METHOD FOR SOLID MATERIAL SHIN-ETSU CHEMICAL CO., LTD. (JP) 2011-06-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110160464-A1 SURFACE TREATMENT METHOD FOR SOLID MATERIAL H1-2, H1-0, HRH3 RELA 2427/4885APP 4448/4885CTDSP1 231/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.