SCHEMBL6399609

SCHEMBL6399609

O=C(NNC=Nc1ccccc1F)c1cc2cc(Cl)ccc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GUSB P08236 12/20 0.59
BCAT1 P54687 3/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
NHERF1 O14745 2/20 0.50
RXFP1 Q9HBX9 1/20 0.50
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
Hydrochloric Acid SCHEMBL6400671 0.99 GUSB (0.58) GUSBBCAT1MEN1KMT2ANHERF1
SCHEMBL6399708 0.95 GUSB (0.54) GUSBBCAT1MEN1KMT2ANHERF1
SCHEMBL6401155 0.89 GUSB (0.57) GUSBBCAT1MEN1KMT2ANHERF1
Hydrochloric Acid SCHEMBL6401280 0.88 GUSB (0.56) GUSBBCAT1MEN1KMT2ANHERF1
SCHEMBL6401160 0.85 GUSB (0.54) GUSBBCAT1MEN1KMT2ANHERF1
SCHEMBL6401775 0.85 BCAT1 (0.58) GUSBBCAT1MEN1KMT2ANHERF1
Fumaric Acid SCHEMBL6406944 0.85 BCAT1 (0.55) GUSBBCAT1MEN1KMT2ANHERF1
SCHEMBL6398783 0.84 GUSB (0.50) GUSBBCAT1MEN1KMT2ARXFP1
SCHEMBL6404131 0.84 GUSB (0.52) GUSBBCAT1MEN1KMT2ANHERF1
SCHEMBL6401075 0.83 MEN1 (0.61) GUSBBCAT1MEN1KMT2ANHERF1

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-6852725-B1 Imidazolyl derivatives SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES, S. A. S. (FR) 2005-02-08 US disclosed