SCHEMBL1104736

SCHEMBL1104736

Cc1ccc(C=C[Si](C)(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 4/20 0.50
RELA Q04206 1/20 0.46
CA1 P00915 1/20 0.46
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
KDM4E B2RXH2 3/20 0.44
CYP2C9 P11712 3/20 0.44
MAPT P10636 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2A6 P11509 1/20 0.44
FBP1 P09467 1/20 0.43
ALOX5 P09917 1/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
HPGD P15428 2/20 0.41
CYP2C19 P33261 2/20 0.40
ACHE P22303 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL5345376 0.78 APP (0.52) NFE2L2RELACA1NPC1RAB9A
SCHEMBL5486754 0.78 NFE2L2 (0.48) NFE2L2RELACA1NPC1RAB9A
SCHEMBL5486756 0.78 NFE2L2 (0.48) NFE2L2RELACA1NPC1RAB9A
(E)-1,2-Di-P-Tolylethene SCHEMBL1305580 0.78 NFE2L2 (0.74) NFE2L2RELACA1NPC1RAB9A
SCHEMBL318785 0.78 NFE2L2 (0.74) NFE2L2RELACA1NPC1RAB9A
(E)-1,2-Di-P-Tolylethene SCHEMBL1305582 0.78 NFE2L2 (0.74) NFE2L2RELACA1NPC1RAB9A
SCHEMBL318786 0.78 NFE2L2 (0.74) NFE2L2RELACA1NPC1RAB9A
(E)-1,2-Di-P-Tolylethene SCHEMBL1793692 0.78 NFE2L2 (0.74) NFE2L2RELACA1NPC1RAB9A
SCHEMBL5845622 0.77 MAOB (0.50) NFE2L2RELANPC1RAB9ASMN1; SMN2
SCHEMBL373962 0.77 MAOB (0.50) NFE2L2RELANPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113943318-A Synthesis method of chiral phenyl silanol and 1, 2-chiral disilicon compound 宁夏大学 2022-01-18 CN disclosed
US-8153835-B2 Fullerene derivatives JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-04-10 US disclosed
US-20090247777-A1 FULLERENE DERIVATIVES JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-10-01 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-20090247777-A1 FULLERENE DERIVATIVES SCO2, C1S, C1R NFE2L2 321/4885RELA 1519/4885CA1 1081/4885

“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.