SCHEMBL12879532

SCHEMBL12879532

COc1ccc(-n2c3ccc([Si](c4ccccc4)(c4ccccc4)c4ccc(C)cc4)cc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccc(OC)cc4)ccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
RAB9A P51151 1/20 0.46
KDM4E B2RXH2 1/20 0.43
MAPT P10636 5/20 0.43
HTT P42858 4/20 0.43
TP53 P04637 1/20 0.42
OXTR P30559 1/20 0.41
HPGD P15428 4/20 0.40
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.40
CUL4A Q13619 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
PDE10A Q9Y233 1/20 0.39
PKM P14618 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL12879535 0.97 KDM4E (0.46) ALDH1A1NPSR1RAB9AKDM4EMAPT
SCHEMBL13138245 0.95 MAPT (0.44) ALDH1A1NPSR1RAB9AKDM4EMAPT
SCHEMBL12879528 0.95 MAPT (0.44) ALDH1A1NPSR1RAB9AKDM4EMAPT
SCHEMBL13138247 0.92 KDM4E (0.47) ALDH1A1KDM4EMAPTHTTOXTR
SCHEMBL13249701 0.91 ALDH1A1 (0.40) ALDH1A1NPSR1RAB9AKDM4EMAPT
SCHEMBL17463274 0.88 ALDH1A1 (0.48) ALDH1A1NPSR1RAB9AKDM4EMAPT
SCHEMBL17463155 0.88 ALDH1A1 (0.48) ALDH1A1NPSR1RAB9AKDM4EMAPT
SCHEMBL25634986 0.87 KDM4E (0.47) ALDH1A1NPSR1KDM4EMAPTHTT
SCHEMBL12879548 0.86 KDM4E (0.38) ALDH1A1RAB9AKDM4EMAPTHTT
SCHEMBL9920552 0.86 KDM4E (0.40) ALDH1A1NPSR1RAB9AKDM4EMAPT

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
US-20110031477-A1 ORGANIC LIGHT-EMITTING DIODES COMPRISING AT LEAST ONE DISILYL COMPOUND SELECTED FROM DISILYLCARBAZOLES, DISILYLDIBENZOFURANS, DISILYLDIBENZOTHIOPHENES, DISILYLDIBENZOPHOLES, DISILYLDIBENZOTHIOPHENE S-OXIDES AND DISILYLDIBENZOTHIOPHENE S,S-DIOXIDES BASF SE (DE) 2011-02-10 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-20110031477-A1 ORGANIC LIGHT-EMITTING DIODES COMPRISING AT LEAST ONE DISILYL COMPOUND SELECTED FROM DISILYLCARBAZOLES, DISILYLDIBENZOFURANS, DISILYLDIBENZOTHIOPHENES, DISILYLDIBENZOPHOLES, DISILYLDIBENZOTHIOPHENE S-OXIDES AND DISILYLDIBENZOTHIOPHENE S,S-DIOXIDES DDT, DDO, GRIN2B ALDH1A1 1009/4885NPSR1 3165/4885RAB9A 4043/4885

“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.