SCHEMBL9687009

SCHEMBL9687009

Cc1ccoc1Cn1c(CN2CCN(C)CC2)nc2cccnc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.49
CHRM1 P11229 1/20 0.49
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SLC6A9 P48067 2/20 0.43
CHKA P35790 1/20 0.39
GPR4 P46093 1/20 0.39
GRM2 Q14416 1/20 0.39
KDM4E B2RXH2 1/20 0.38
HTR3E A5X5Y0 1/20 0.38
HTR3B O95264 1/20 0.38
HTR1A P08908 1/20 0.38
HTR2C P28335 1/20 0.38
HTR3A P46098 1/20 0.38
HTR3D Q70Z44 1/20 0.38
HTR3C Q8WXA8 1/20 0.38
LMNA P02545 1/20 0.37
HRH4 Q9H3N8 1/20 0.37

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
Fumaric Acid SCHEMBL9634964 0.92 CHRM5 (0.52) CHRM5CHRM1KMT2AMEN1USP2
SCHEMBL9686523 0.88 TP53 (0.40) CHRM5CHRM1SLC6A9GPR4HTR3E
SCHEMBL9687078 0.83 CHRM5 (0.50) CHRM5CHRM1KMT2AMEN1USP2
Fumaric Acid SCHEMBL9636371 0.81 CHRM5 (0.41) CHRM5CHRM1SLC6A9KDM4ELMNA
SCHEMBL9684792 0.80 CHRM5 (0.49) CHRM5CHRM1KMT2AMEN1USP2
SCHEMBL9634955 0.79 CHRM5 (0.57) CHRM5CHRM1KMT2AMEN1USP2
SCHEMBL9634927 0.77 CHRM5 (0.50) CHRM5CHRM1KMT2AMEN1USP2
Fumaric Acid SCHEMBL9635803 0.76 CHRM5 (0.52) CHRM5CHRM1KMT2AMEN1USP2
SCHEMBL9686691 0.76 CHRM5 (0.49) CHRM5CHRM1KMT2AMEN1USP2
SCHEMBL9686512 0.76 SLC6A9 (0.68) CHRM5CHRM1KMT2AMEN1USP2

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-0307014-B1 ANTI-ALLERGIC 2-(HETEROCYCLYL ALKYL) IMIDAZO PYRIDINES AND 2-(HETEROCYCLYL ALKYL) PURINES JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-09 EP disclosed