SCHEMBL597971

SCHEMBL597971

CCc1ccc(C(=O)[C@]2(n3cc(F)c(N)nc3=O)CC[C@@H](CO)O2)cc1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALB P02768 1/20 0.35
EP300 Q09472 5/20 0.35
DCK P27707 7/20 0.32
LPAR1 Q92633 1/20 0.31
IDH1 O75874 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
SCHEMBL597961 0.91 ALB (0.37) ALBEP300DCK
SCHEMBL597543 0.90 DCK (0.40) ALBEP300DCK
SCHEMBL598982 0.89 DCK (0.41) ALBEP300DCK
SCHEMBL597929 0.84 DCK (0.40) ALBDCK
SCHEMBL597288 0.82 DCK (0.45) ALBDCK
SCHEMBL598749 0.82 ALB (0.38) ALBEP300DCK
SCHEMBL599086 0.77 EP300 (0.37) ALBEP300
SCHEMBL598527 0.72 ABL1 (0.40) ALB
SCHEMBL4585233 0.71 DCK (0.39) ALBEP300DCK
SCHEMBL4585353 0.69 DCK (0.40) ALBEP300DCK

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-8114997-B2 N4-acylcytosine nucleosides for treatment of viral infections PHARMASSET, INC. (US) 2012-02-14 US disclosed