SCHEMBL8840969

SCHEMBL8840969

CCC(=O)c1cc2c(s1)CCC1CC(=O)N(c3ccc(Cl)cc3)N=C21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37
GABRA4 P48169 1/20 0.37
GABRE P78334 1/20 0.37
GABRA6 Q16445 1/20 0.37
GABRG1 Q8N1C3 1/20 0.37
GABRG3 Q99928 1/20 0.37
GABRQ Q9UN88 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
SCHEMBL9411313 0.93 MAPT (0.39) MAPTKDM4ENPC1RAB9AGABRP
SCHEMBL8840963 0.89 GABRP (0.47) MAPTKDM4ENPC1RAB9AGABRP
SCHEMBL8840946 0.86 EP300 (0.33) MAPTKDM4ENPC1RAB9AGABRP
SCHEMBL9411303 0.84 NPSR1 (0.39) MAPTKDM4ENPC1RAB9AGABRP
SCHEMBL8840956 0.84 GABRP (0.50) MAPTKDM4ENPC1RAB9AGABRP
SCHEMBL9411277 0.81 GABRP (0.38) MAPTKDM4ENPC1RAB9AGABRP
SCHEMBL8840997 0.81 KMT2A (0.33) MAPTKDM4ENPC1RAB9AKMT2A
SCHEMBL9738054 0.77 MAPT (0.41) MAPTKDM4ENPC1RAB9AGABRP
SCHEMBL8840973 0.76 ACHE (0.48) MAPTKDM4ENPC1RAB9AGABRP
SCHEMBL9737592 0.75 MAPT (0.36) MAPTKDM4ENPC1RAB9AGABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0601184-A1 FUSED PYRIDAZINE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-06-15 EP claimed
US-5597918-A ANXIOLYTIC AGENTS, SIDE EFFECT REDUCTION YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-01-28 US disclosed
EP-0601184-A1 FUSED PYRIDAZINE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-06-15 EP disclosed