SCHEMBL5416786

SCHEMBL5416786

CC(C)(N)CCn1ncc(N)c1N

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL5422212 0.89
SCHEMBL5422087 0.88 PNP (0.33)
SCHEMBL5424918 0.84 CPB1 (0.33) TSHR
SCHEMBL5420176 0.81 TSHR (0.33) TSHR
SCHEMBL2923881 0.80 TSHR (0.34) TSHR
SCHEMBL6263220 0.79
SCHEMBL5420320 0.78 TSHR (0.30) TSHR
SCHEMBL5420597 0.78
Hydrochloric Acid SCHEMBL6757419 0.78 TSHR (0.33) TSHR
SCHEMBL5159269 0.76 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7250063-B2 Diaminopyrazole derivatives and their use for oxidation dyeing of keratinous fibres L'OREAL (FR) 2007-07-31 US disclosed