SCHEMBL9602580

SCHEMBL9602580

CC(CN(C)C)Oc1ccc(N2N=C3c4ccccc4CCC3CC2=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.39
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP3 P42574 1/20 0.38
RECQL P46063 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TOP1 P11387 1/20 0.36
ACHE P22303 3/20 0.35
DRD2 P14416 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32

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
SCHEMBL9603147 0.88 MCHR1 (0.35) MCHR1MAPTALDH1A1TOP1ACHE
SCHEMBL9602772 0.88 MCHR1 (0.35) MCHR1KDM4EMAPTALDH1A1GAA
SCHEMBL9866052 0.87 MCHR1 (0.34) MCHR1KDM4EMAPTALDH1A1GAA
SCHEMBL9603188 0.87 MAPT (0.37) KDM4ENPC1RAB9AMAPTALDH1A1
SCHEMBL9868430 0.87 TOP1 (0.35) MCHR1NPC1RAB9AMAPK1TOP1
SCHEMBL9866334 0.87 ALDH1A1 (0.38) KDM4ENPC1RAB9AMAPTALDH1A1
Iodide SCHEMBL10445218 0.86 ALDH1A1 (0.38) KDM4ENPC1RAB9AMAPTALDH1A1
SCHEMBL9866881 0.83 MAPT (0.39) KDM4ENPC1RAB9AMAPTALDH1A1
SCHEMBL9865229 0.83 TOP1 (0.35) MCHR1MAPTALDH1A1GAAL3MBTL1
Fumaric Acid SCHEMBL9867491 0.82 ALDH1A1 (0.35) MCHR1KDM4ENPC1RAB9AMAPT

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