SCHEMBL5429888

SCHEMBL5429888

CC(CCN(C)C)Cn1ncc(N)c1N

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
HTR2A P28223 1/20 0.30
HRH1 P35367 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
SCHEMBL5420317 0.91 HTR2A (0.33) HTR2AHRH1
SCHEMBL5420586 0.86
SCHEMBL5427247 0.85 CHRM2 (0.39) TSHR
SCHEMBL5382826 0.80 HTR2C (0.35) TSHRHTR2A
SCHEMBL5394309 0.80 TSHR (0.34) TSHRHTR2A
SCHEMBL5160714 0.80 TSHR (0.34) TSHRHTR2A
SCHEMBL5396974 0.78 TSHR (0.33) TSHRHTR2A
SCHEMBL14445277 0.78 TSHR (0.33) TSHRHTR2AHRH1
SCHEMBL1799691 0.78 CNR1 (0.35) TSHR
SCHEMBL5449825 0.77 CHRM2 (0.34) TSHRHTR2A

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