SCHEMBL4698011

SCHEMBL4698011

CC[C@H](C)Nc1cc(N2CC[C@@H](NC)C2)ncn1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 20/20 0.62
HRH3 Q9Y5N1 2/20 0.46
KCNH2 Q12809 1/20 0.45

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
SCHEMBL1774250 1.00 HRH4 (0.62) HRH4HRH3KCNH2
SCHEMBL1774623 0.90 HRH4 (0.48) HRH4HRH3
SCHEMBL1774585 0.90 HRH4 (0.48) HRH4HRH3
SCHEMBL1774592 0.88 HRH4 (0.66) HRH4
SCHEMBL1774402 0.83 HRH4 (0.68) HRH4HRH3KCNH2
SCHEMBL18601594 0.83 HRH4 (0.68) HRH4HRH3KCNH2
SCHEMBL18601595 0.83 HRH4 (0.68) HRH4HRH3KCNH2
SCHEMBL1774816 0.82 HRH4 (0.67) HRH4HRH3KCNH2
SCHEMBL1774331 0.82 HRH4 (0.68) HRH4HRH3KCNH2
SCHEMBL1775267 0.82 HRH4 (0.68) HRH4HRH3KCNH2

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
EP-1966162-B1 PYRIMIDINE DERIVATIVES ZIARCO PHARMA LTD (GB) 2017-03-15 EP disclosed
EP-1966162-A2 PYRIMIDINE DERIVATIVES Pfizer Limited (GB) 2008-09-10 EP disclosed
WO-2007072163-A2 PYRIMIDINE DERIVATIVES PFIZER LIMITED (GB) 2007-06-28 WO disclosed