SCHEMBL3945812

SCHEMBL3945812

Nc1cnn(CCNCCn2ncc(N)c2N)c1N

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL5411849 0.91 TERT (0.33)
SCHEMBL5433854 0.89 TSHR (0.30) TSHR
SCHEMBL2923881 0.84 TSHR (0.34) TSHR
SCHEMBL14223954 0.84
SCHEMBL5425117 0.84 TSHR (0.32) TSHR
Hydrochloric Acid SCHEMBL6757419 0.82 TSHR (0.33) TSHR
SCHEMBL3944376 0.80 TSHR (0.32) TSHR
Hydrochloric Acid SCHEMBL6759507 0.78 TSHR (0.32) TSHR
Bromide SCHEMBL5848621 0.77 HTR2A (0.40) TSHR
SCHEMBL5159269 0.77 POLB (0.40) TSHR

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
EP-1413286-B1 Dyeing composition comprising at least one heterocyclic oxidation base and at least one substituted 2,3-diaminopyridine as a coupling agent OREAL (FR) 2009-04-22 EP claimed
EP-1413286-A1 Dyeing composition comprising at least one heterocyclic oxidation base and at least one substituted 2,3-diaminopyridine as a coupling agent L'OREAL (FR) 2004-04-28 EP claimed
EP-1413286-B1 Dyeing composition comprising at least one heterocyclic oxidation base and at least one substituted 2,3-diaminopyridine as a coupling agent OREAL (FR) 2009-04-22 EP disclosed
EP-1413286-A1 Dyeing composition comprising at least one heterocyclic oxidation base and at least one substituted 2,3-diaminopyridine as a coupling agent L'OREAL (FR) 2004-04-28 EP disclosed