SCHEMBL3777402

SCHEMBL3777402

C=C[Si](C)(C)C(Nc1ccccc1)[Si](C(C)C)(C(C)C)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
ALDH1A1 P00352 2/20 0.38
CYP3A4 P08684 2/20 0.38
ALOX15 P16050 2/20 0.38
TSHR P16473 2/20 0.38
ALOX12 P18054 2/20 0.38
HSD17B10 Q99714 2/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
RECQL P46063 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 1/20 0.38
KDM4E B2RXH2 1/20 0.35
KCNH3 Q9ULD8 1/20 0.34
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.33
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30
TGM2 P21980 1/20 0.30

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
SCHEMBL3780482 0.84 TDP1 (0.42) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL3774852 0.79 TDP1 (0.37) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL3777015 0.79 TDP1 (0.37) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL3777394 0.69
SCHEMBL27337982 0.66 TDP1 (0.56) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL2350755 0.66 TDP1 (0.56) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL3766027 0.63
SCHEMBL3772385 0.63
SCHEMBL8744842 0.63 TDP1 (0.64) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL4964227 0.62 TDP1 (0.44) TDP1ALDH1A1CYP3A4ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436166-B2 Amino-containing vinylsilane compounds and making method SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-05-07 US disclosed
US-20100317852-A1 AMINO-CONTAINING VINYLSILANE COMPOUNDS AND MAKING METHOD SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-12-16 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-20100317852-A1 AMINO-CONTAINING VINYLSILANE COMPOUNDS AND MAKING METHOD BHMT2, GNMT, VASP TDP1 2587/4885ALDH1A1 4204/4885CYP3A4 2558/4885

“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.