SCHEMBL4946987

SCHEMBL4946987

c1cc2cc(c1)Cc1cccc(c1)CNC2

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHKA P35790 3/20 0.38
APEX1 P27695 2/20 0.38
ACHE P22303 1/20 0.34
TERT O14746 1/20 0.33
KCNN3 Q9UGI6 1/20 0.31

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
SCHEMBL21955684 0.92 APEX1 (0.42) CHKAAPEX1TERTKCNN3
SCHEMBL4359812 0.92
SCHEMBL19089065 0.92 APEX1 (0.42) CHKAAPEX1TERTKCNN3
SCHEMBL30547267 0.83 CHKA (0.32) CHKAACHE
SCHEMBL29894137 0.83 CHKA (0.32) CHKAACHE
SCHEMBL30945595 0.83 CHKA (0.32) CHKAACHE
Hydrogen Sulfide SCHEMBL23044042 0.80 CHKA (0.31) CHKAACHE
SCHEMBL30050918 0.79 APEX1 (0.60) CHKAAPEX1TERT
SCHEMBL29386754 0.79 APEX1 (0.60) CHKAAPEX1TERT
Ammonia Solution, Strong SCHEMBL3063865 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080146768-A1 PROCESSES FOR PREPARING POLYMERS USING ALPHA,OMEGA-DIFUNCTIONAL ALDARAMIDES E. I. DU PONT DE NEMOURS AND COMPANY 2008-06-19 US disclosed
EP-1858955-A1 PROCESSES USING ALPHA, OMEGA-DIFUNCTIONAL ALDARAMIDES AS MONOMERS AND CROSSLINKERS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2007-11-28 EP disclosed
US-20060264672-A1 Processes using alpha, omega-difunctional aldaramides as monomers and crosslinkers E. I. DU PONT DE NEMOURS AND COMPANY 2006-11-23 US disclosed
WO-2006091901-A1 PROCESSES USING ALPHA, OMEGA-DIFUNCTIONAL ALDARAMIDES AS MONOMERS AND CROSSLINKERS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2006-08-31 WO 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-20060264672-A1 Processes using alpha, omega-difunctional aldaramides as monomers and crosslinkers ALOX5, GSTO1, FASN CHKA 405/4885APEX1 624/4885ACHE 499/4885

“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.