SCHEMBL8027644

SCHEMBL8027644

Cc1nc2c3c(ccc2s1)C(C)N(C)CC3

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.35
RAB9A P51151 1/20 0.35
MAOA P21397 2/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ASIC3 Q9UHC3 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL1011527 0.73 NPC1 (0.36) NPC1RAB9AMAOAMAPTSMN1; SMN2
SCHEMBL8015297 0.72 DRD3 (0.36) MAOA
SCHEMBL8022070 0.69 MAOA (0.41) MAOA
SCHEMBL12930243 0.67 NPC1 (0.57) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL8030417 0.65 MEN1 (0.44) MAOA
SCHEMBL7978723 0.65 GID4 (0.44) MAOASMN1; SMN2LMNA
SCHEMBL8027387 0.65 GID4 (0.44) MAOA
SCHEMBL8028688 0.65 ADRA2A (0.50) MAOA
SCHEMBL16762220 0.63 DYRK1A (0.47) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL8027390 0.63 MAOA (0.53) MAOA

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
WO-2009095253-A1 6-HALO-PYRAZOLO[1, 5-A]PYRIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR (MGLUR) MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2009-08-06 WO disclosed