SCHEMBL8920735

SCHEMBL8920735

CC/C=C/C=C/C(C)c1ccnc(F)c1C(N)=O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 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
SCHEMBL8938212 0.87
SCHEMBL8938209 0.87
SCHEMBL8938206 0.87
SCHEMBL8920764 0.70 GABRP (0.40)
SCHEMBL28018456 0.64 SIRT3 (0.43)
SCHEMBL2338841 0.64 NAPRT (0.38)
SCHEMBL8920760 0.63
SCHEMBL21250761 0.62 TOP2A (0.36)
SCHEMBL8918115 0.62 PARP10 (0.31) PARP10
SCHEMBL8918184 0.62 MKNK1 (0.32) PARP10

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-5691366-A UNSATURATED NITRO OXIME FORMED BY REACTION OF DINITROGEN TRIOXIDE WITH DIOLEFIN ETHER, SULFIDE OR AMINE TO BE USED AS VASODILATORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-11-25 US disclosed