SCHEMBL3196129

SCHEMBL3196129

CN(C)c1ccccc1[N]c1ccccc1N(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
GAA P10253 3/20 0.48
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 4/20 0.43
TSHR P16473 2/20 0.43
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CHEK1 O14757 1/20 0.41
NEK2 P51955 1/20 0.41
LIMK1 P53667 1/20 0.41
DYRK1A Q13627 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
MAPK1 P28482 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
HTR6 P50406 1/20 0.38
NSD2 O96028 1/20 0.38
EGFR P00533 1/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SIGMAR1 Q99720 2/20 0.37

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
SCHEMBL8722208 0.84 MAPT (0.48) MAPTGAAKDM4EALDH1A1TSHR
SCHEMBL9196551 0.82 MAPT (0.46) MAPTGAAKDM4EALDH1A1TSHR
SCHEMBL150284 0.80 MAPT (0.45) MAPTGAAKDM4EALDH1A1TSHR
SCHEMBL30882155 0.80 MAPT (0.45) MAPTGAAKDM4EALDH1A1TSHR
SCHEMBL21578004 0.80 MAPT (0.44) MAPTGAAKDM4EALDH1A1TSHR
SCHEMBL3418201 0.80 MAPT (0.44) MAPTGAAKDM4EALDH1A1TSHR
SCHEMBL15988140 0.80 MAPT (0.44) MAPTGAAKDM4EALDH1A1TSHR
Hydrochloric Acid SCHEMBL9404129 0.78 MAPT (0.43) MAPTGAAKDM4EALDH1A1TSHR
Hydrochloric Acid SCHEMBL10435549 0.77 MAPT (0.42) MAPTGAAKDM4EALDH1A1TSHR
SCHEMBL9191359 0.77 MAPT (0.41) MAPTGAAKDM4EALDH1A1TSHR

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
US-7659416-B2 Monomolecular conductive complex, conductive self-assembled film and assembly of electrode composed of metal and semiconductor making use of the same TOKYO INSTITUTE OF TECHNOLOGY (JP) 2010-02-09 US disclosed
US-20090036698-A1 Monomolecular Conductive Complex, Conductive Self-Assembled Film and Assembly of Electrode Composed of Metal and Semiconductor Making Use of the Same TOKYO INSTITUTE OF TECHNOLOGY 2009-02-05 US disclosed
EP-1862453-A1 MONOMOLECULAR CONDUCTIVE COMPLEX, CONDUCTIVE SELF-ASSEMBLED FILM AND ASSEMBLY OF ELECTRODE COMPOSED OF METAL AND SEMICONDUCTOR MAKING USE OF THE SAME Tokyo Institute of Technology (JP) 2007-12-05 EP 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-20090036698-A1 Monomolecular Conductive Complex, Conductive Self-Assembled Film and Assembly of Electrode Composed of Metal and Semiconductor Making Use of the Same CNTN1, GAP43, AP3M1 MAPT 1911/4885GAA 4766/4885KDM4E 3607/4885

“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.