SCHEMBL4443152

SCHEMBL4443152

NC1=NC(=O)N=C[C]1C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 1/20 0.32
PRKACG P22612 1/20 0.32
PRKACB P22694 1/20 0.32

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
SCHEMBL4434515 0.71
SCHEMBL5604658 0.70
SCHEMBL16497484 0.67
SCHEMBL10910607 0.67
SCHEMBL11004832 0.67
SCHEMBL8194724 0.67
SCHEMBL17891233 0.65 PRKACA (0.31) PRKACAPRKACGPRKACB
SCHEMBL1693134 0.64
Hydrochloric Acid SCHEMBL27545281 0.62
SCHEMBL546482 0.62

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-2134736-A1 FIVE- AND SIX-MEMBERED CONFORMATIONALLY LOCKED 2',4'- CARBOCYCLIC RIBO-THYMIDINES FOR THE TREATMENT OF INFECTIONS AND CANCER Chattopadhyaya, Jyoti (SE) 2009-12-23 EP claimed
WO-2008111908-A1 FIVE- AND SIX-MEMBERED CONFORMATIONALLY LOCKED 2',4'- CARBOCYCLIC RIBO-THYMIDINES FOR THE TREATMENT OF INFECTIONS AND CANCER CHATTOPADHYAYA JYOTI (SE) 2008-09-18 WO claimed