SCHEMBL2847405

SCHEMBL2847405

CCCCCNc1nc(N)nc(C)c1Cc1ccc(CCl)cc1OC.[O-][S+](Cl)Cl

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.72

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
SCHEMBL29378963 0.95 TLR7 (0.78) TLR7
SCHEMBL4214225 0.95 TLR7 (0.78) TLR7
SCHEMBL2845663 0.93 TLR7 (0.78) TLR7
SCHEMBL2852348 0.87 TLR7 (0.69) TLR7
SCHEMBL24243980 0.86 TLR7 (0.78) TLR7
SCHEMBL855054 0.86 TLR7 (0.81) TLR7
SCHEMBL20212322 0.85 TLR7 (0.78) TLR7
SCHEMBL10310977 0.84 TLR7 (0.78) TLR7
SCHEMBL2843491 0.84 TLR7 (1.00) TLR7
SCHEMBL4203312 0.84 TLR7 (0.74) TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222648-A1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ASTHMA, COPD, ALLERGIC RHINITIS, ALLERGIC CONJUNCTIVITIS, ATOPIC DERMATITIS, CANCER, HEPATITIS B, HEPATITIS C, HIV, HPV, BACTERIAL INFECTIONS AND DERMATOSIS AstraZeneca AB (SE) 2010-09-01 EP disclosed
WO-2009067081-A1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ASTHMA, COPD, ALLERGIC RHINITIS, ALLERGIC CONJUNCTIVITIS, ATOPIC DERMATITIS, CANCER, HEPATITIS B, HEPATITIS C, HIV, HPV, BACTERIAL INFECTIONS AND DERMATOSIS ASTRAZENECA AB (SE) 2009-05-28 WO disclosed