SCHEMBL8330063

SCHEMBL8330063

Cc1ccc2c(Nc3ccc(Oc4ccccn4)cc3)c(C(=O)O)cnc2n1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.43
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
P2RX3 P56373 13/20 0.41
IGF1R P08069 1/20 0.41
MAPT P10636 1/20 0.41
PDE10A Q9Y233 1/20 0.41

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
SCHEMBL8327170 0.89 MAPT (0.55) GAASMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL8323053 0.88 MAPT (0.54) GAASMN1; SMN2MAPT
SCHEMBL8329674 0.83 MAPT (0.43) DHODHSMN1; SMN2P2RX3MAPT
SCHEMBL8327174 0.82 P2RX3 (0.43) P2RX3
SCHEMBL8328406 0.77 PDE10A (0.46) GAAP2RX3IGF1RMAPTPDE10A
Hydrochloric Acid SCHEMBL8327918 0.75 PDE10A (0.47) P2RX3IGF1RPDE10A
SCHEMBL8328461 0.75 MAPT (0.52) GAASMN1; SMN2MAPT
SCHEMBL8327738 0.74 MAPT (0.41) DHODHSMN1; SMN2P2RX3MAPTPDE10A
Hydrochloric Acid SCHEMBL8328640 0.74 MAPT (0.51) GAASMN1; SMN2MAPT
SCHEMBL8321309 0.74 PDE4B (0.61) GAASMN1; SMN2MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0705260-B1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AG (DE) 1999-03-03 EP claimed
EP-0705260-A1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AKTIENGESELLSCHAFT (DE) 1996-04-10 EP claimed