SCHEMBL7115996

SCHEMBL7115996

C=Cc1c(C)cc([AsH2])nc1C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDXK O00764 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
SCHEMBL7049656 0.75 NOS2 (0.40) PDXK
SCHEMBL20170158 0.65
SCHEMBL106587 0.64 RAPGEF4 (0.39)
SCHEMBL28010690 0.64 TP53 (0.32)
SCHEMBL11356059 0.64 RAPGEF4 (0.39)
SCHEMBL9797831 0.64 PDXK (0.32) PDXK
Methane SCHEMBL14658320 0.62 RAPGEF4 (0.38)
Hydrogen Sulfide SCHEMBL29194420 0.62 RAPGEF4 (0.38)
SCHEMBL22306049 0.62 LMNA (0.36) PDXK
SCHEMBL10812798 0.62 ALDH1A1 (0.33)

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
WO-2003013523-A1 SH3 PROTEIN DOMAINS AND THEIR LIGANDS ADELAIDE RESEARCH & INNOVATION PTY LTD (AU) 2003-02-20 WO claimed