SCHEMBL3788910

SCHEMBL3788910

CC(C)(C)c1cc(I)cc(C(C)(C)C)c1O[Si](C)(C)C

nearest known ligand 0.30

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
ATP2A2 P16615 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ATP2A3 Q93084 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
SCHEMBL9637933 0.79 MAPT (0.36) KDM4EALDH1A1CYP1A2MAPTALOX15
SCHEMBL10659842 0.79 KDM4E (0.30) KDM4EALDH1A1CYP1A2MAPTALOX15
SCHEMBL10661289 0.79 KDM4E (0.30) KDM4EALDH1A1CYP1A2MAPTALOX15
SCHEMBL1826724 0.79 PTGDR2 (0.33) KDM4EALDH1A1CYP1A2MAPTALOX15
SCHEMBL10657572 0.78
SCHEMBL10576170 0.78
SCHEMBL10658775 0.76 KDM4E (0.32) KDM4EALDH1A1CYP1A2MAPTALOX15
SCHEMBL10657582 0.76
SCHEMBL2065796 0.76 PTGS2 (0.46) KDM4EALDH1A1CYP1A2MAPTALOX15
SCHEMBL7771628 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150037069-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER AND IMAGE FORMING APPARATUS KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2015-02-05 US disclosed
US-20100197783-A1 Radiation Protection Using Single Wall Carbon Nanotube Derivatives DARPA 2010-08-05 US disclosed
US-20100197783-A1 Radiation Protection Using Single Wall Carbon Nanotube Derivatives DARPA 2010-08-05 US disclosed
US-20100197783-A1 Radiation Protection Using Single Wall Carbon Nanotube Derivatives DARPA 2010-08-05 US disclosed
WO-2008118960-A2 RADIATION PROTECTION USING CARBON NANOTUBE DERIVATIVES WILLIAM MARSH RICE UNIVERSITY (US) 2008-10-02 WO disclosed
WO-2008118960-A2 RADIATION PROTECTION USING CARBON NANOTUBE DERIVATIVES WILLIAM MARSH RICE UNIVERSITY (US) 2008-10-02 WO disclosed
US-4708966-A SUBSTITUTED DI-TERT-BUTYL PHENOL DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 1987-11-24 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-20100197783-A1 Radiation Protection Using Single Wall Carbon Nanotube Derivatives POT1, MGMT, CTSA KDM4E 4587/4885ALDH1A1 1246/4885CYP1A2 1796/4885

“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.