SCHEMBL9694399

SCHEMBL9694399

CCOC(=O)CNc1ncccc1NC(=O)c1cc(Cl)ccn1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PYGL P06737 1/20 0.44
PYGM P11217 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 2/20 0.42
HTT P42858 2/20 0.42
MAPK1 P28482 1/20 0.42
MAPT P10636 3/20 0.42
GAA P10253 1/20 0.42
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
ANO1 Q5XXA6 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 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
SCHEMBL9692226 0.89 RAB9A (0.51) NPC1RAB9AALDH1A1HTTMAPT
SCHEMBL9692044 0.87 KMT2A (0.55) NPC1RAB9AL3MBTL1ALDH1A1HTT
SCHEMBL9694296 0.86 NPC1 (0.55) NPC1RAB9AL3MBTL1HTTMAPT
SCHEMBL9694086 0.83 RAB9A (0.52) NPC1RAB9AL3MBTL1ALDH1A1HTT
SCHEMBL9692244 0.83 GAA (0.53) NPC1RAB9AL3MBTL1HTTMAPK1
SCHEMBL9693812 0.82 HTT (0.60) NPC1RAB9AL3MBTL1ALDH1A1HTT
SCHEMBL9692090 0.79 LMNA (0.55) NPC1RAB9AL3MBTL1ALDH1A1HTT
SCHEMBL9694270 0.79 TDP1 (0.51) NPC1RAB9AL3MBTL1ALDH1A1HTT
SCHEMBL9694154 0.79 SMN1; SMN2 (0.57) NPC1RAB9AALDH1A1HTTMAPT
SCHEMBL9692206 0.78 F10 (0.55) NPC1RAB9AALDH1A1HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0255217-B1 FUSED IMIDAZOHETEROCYCLIC COMPOUNDS A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1992-01-22 EP disclosed
US-4948800-A MUSCLE RELAXANTS; ANTICONVULSANTS; ANXIOLYTIC AGENTS; 3-HYDROXYALKYL-PYRIDO(4,5-B OR-C)IMIDAZOLE COMPOUNDS A. H. ROBINS COMPANY, INCORPORATED (US) 1990-08-14 US disclosed
US-4914109-A ANTICONVULSANTS, ANTIANXIETY AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1990-04-03 US disclosed
US-4873251-A MUSCLE RELAXANTS, ANTICONVULSANTS, ANTIANXIETY AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1989-10-10 US disclosed
US-4824951-A MUSCLE RELAXANTS, ANTICONVULSANTS, ANXIOLYTIC AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1989-04-25 US disclosed
US-4772600-A MUSCLE RELAXANTS, ANTICONVULSANTS, ANXIOLYTIC A. H. ROBINS COMPANY, INC. (US) 1988-09-20 US disclosed
EP-0255217-A1 Fused imidazoheterocyclic compounds A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1988-02-03 EP disclosed