SCHEMBL30770822

SCHEMBL30770822

COc1cc(F)c(Cc2nc3cc(N)cnc3[nH]2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 9/20 0.40
FGFR2 P21802 8/20 0.40
TAAR1 Q96RJ0 1/20 0.39
FGFR1 P11362 4/20 0.36
TRAP1 Q12931 2/20 0.36
HSP90B1 P14625 1/20 0.36
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
F10 P00742 1/20 0.33

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
SCHEMBL986239 0.80 GRIN1 (0.47) FGFR3
SCHEMBL984741 0.74 MAPT (0.36) F10
SCHEMBL986984 0.73 MAPT (0.39) F10
SCHEMBL984487 0.72 GAA (0.41) FGFR3
SCHEMBL3590092 0.70 TDP1 (0.39)
SCHEMBL986423 0.68 NPC1 (0.44)
SCHEMBL986302 0.68 MAPT (0.44) HSP90AB1
SCHEMBL986771 0.68 NPC1 (0.56)
SCHEMBL12930083 0.66 NPC1 (0.42) FGFR3FGFR2FGFR1
SCHEMBL13607904 0.66 GRIN1 (0.46) FGFR3FGFR2

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
CN-111757883-B Novel inhibitors of bacterial glutaminyl cyclase for the treatment of periodontal disease and related diseases 弗劳恩霍夫应用研究促进协会 2024-02-13 CN disclosed