SCHEMBL9602162

SCHEMBL9602162

O=C1CC2CCc3ccc(F)cc3C2=NN1c1ccccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.37
KDM4E B2RXH2 4/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
PTGS2 P35354 2/20 0.35
ACHE P22303 1/20 0.34
PIN1 Q13526 2/20 0.34
ADAM17 P78536 1/20 0.34
MAPT P10636 4/20 0.33
ALDH1A1 P00352 4/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
GAA P10253 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
GLA P06280 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP3 P42574 1/20 0.33
RECQL P46063 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33

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
SCHEMBL9602148 0.87 KDM4E (0.45) KDM4ENPC1RAB9APTGS2ACHE
SCHEMBL10366385 0.84 KDM4E (0.43) MAOBKDM4ENPC1RAB9APTGS2
SCHEMBL9601954 0.83 MAOB (0.40) MAOBKDM4ENPC1RAB9APTGS2
SCHEMBL9601936 0.82 MAOB (0.40) MAOBKDM4ENPC1RAB9APTGS2
SCHEMBL10373269 0.79 PTGS2 (0.40) MAOBKDM4ENPC1RAB9APTGS2
SCHEMBL10365659 0.78 GRM5 (0.38) MAOBKDM4ENPC1RAB9APTGS2
SCHEMBL9605374 0.78 XIAP (0.33) KDM4ENPC1RAB9AACHEALDH1A1
SCHEMBL10367909 0.75 GRM5 (0.36) MAOBKDM4ENPC1RAB9APTGS2
SCHEMBL9865057 0.73 PBRM1 (0.39) KDM4ENPC1RAB9APTGS2MAPT
SCHEMBL9601493 0.73 MAPT (0.40) MAOBKDM4ENPC1RAB9AMAPT

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-0351435-B1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1993-08-04 EP disclosed
US-5045541-A Immunodeficiency disorders YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-09-03 US disclosed
EP-0351435-A1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-24 EP disclosed