SCHEMBL22729940

SCHEMBL22729940

Cc1cc(-c2ccc3nnn(Cc4cccc5cccnc45)c3n2)ccc1C(=O)NOC(C)(C)CO

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.35
SLC22A12 Q96S37 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
KCNH2 Q12809 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
ADORA2A P29274 4/20 0.34
ADORA1 P30542 4/20 0.34
MMP9 P14780 1/20 0.33
MAP4K4 O95819 1/20 0.33
DGAT2 Q96PD7 1/20 0.33
KDR P35968 3/20 0.33
NPC1 O15118 1/20 0.33
CASP3 P42574 1/20 0.33
RAB9A P51151 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 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
SCHEMBL22729945 0.92 MET (0.36) METSLC22A12PSEN1PSEN2KCNH2
SCHEMBL15288518 0.87 MET (0.47) MET
SCHEMBL22729949 0.85 MET (0.35) METSLC22A12PSEN1PSEN2KCNH2
SCHEMBL22729912 0.85 MET (0.35) METSLC22A12PSEN1PSEN2KCNH2
SCHEMBL20530360 0.85 SLC22A12 (0.40) METSLC22A12PSEN1PSEN2KCNH2
SCHEMBL20530317 0.80 MET (0.40) METSLC22A12KCNH2ADORA2AADORA1
SCHEMBL15288646 0.79 MET (0.47) MET
SCHEMBL22729926 0.79 MET (0.36) METSLC22A12PSEN1PSEN2KCNH2
SCHEMBL22729928 0.79 ADORA2A (0.37) METADORA2AADORA1DGAT2
SCHEMBL20530335 0.78 MET (0.47) METSLC22A12ADORA2AADORA1KDR

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
EP-2831073-B1 NOVEL 3,5-DISUBSTITUED-3H-IMIDAZO[4,5-B]PYRIDINE AND 3,5- DISUBSTITUED -3H-[1,2,3]TRIAZOLO[4,5-B]PYRIDINE COMPOUNDS AS MODULATORS OF C-MET PROTEIN KINASES RHIZEN PHARMACEUTICALS S A (CH) 2020-12-09 EP claimed