SCHEMBL7697335

SCHEMBL7697335

Nc1cc(OC(=O)c2nccc(F)n2)nc(O)n1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.32
KMT2A Q03164 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
SCHEMBL7697331 0.76 KMO (0.42)
SCHEMBL351032 0.69 KDM4E (0.40) KMT2A
SCHEMBL7697488 0.64 KMO (0.53)
SCHEMBL31413728 0.64 KMO (0.53)
SCHEMBL24087665 0.63 KMO (0.37)
SCHEMBL3170736 0.61 ALDH1A1 (0.47) KMT2A
SCHEMBL27725996 0.59
SCHEMBL3714129 0.59 ROCK1 (0.44) GAA
SCHEMBL1389268 0.59
SCHEMBL10829516 0.56 ALDH1A1 (0.46) KMT2A

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-6337368-B1 WATER INSOLUBLE CARRIERS WITH P-NITROBENZOIC ACID, AROMATIC AMINES, AMIDES, SULFONAMIDES AND HYDRAZIDES KANEKA CORPORATION (JP) 2002-01-08 US disclosed