SCHEMBL8568996

SCHEMBL8568996

COCCN1CCC(N2C(=O)Nc3ccccc3C2c2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.49
CALCRL Q16602 1/20 0.40
SLC18A3 Q16572 1/20 0.40
CHRM2 P08172 1/20 0.39
CHRM3 P20309 1/20 0.39
PDE6D O43924 5/20 0.38
PARP1 P09874 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TACR1 P25103 1/20 0.37
SLC6A9 P48067 1/20 0.37
CHRM1 P11229 1/20 0.37
DRD2 P14416 1/20 0.37
KCNH2 Q12809 1/20 0.37
CTSS P25774 1/20 0.37
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL8567952 0.85 SLC18A3 (0.49) KDM1ASLC18A3PDE6DTACR1
SCHEMBL8564971 0.85 TACR1 (0.43) PDE6DMEN1KMT2ATACR1DRD2
SCHEMBL8571012 0.84 CHRM2 (0.49) CHRM2CHRM3MEN1KMT2ADRD2
SCHEMBL8564042 0.84 CHRM2 (0.43) KDM1ACALCRLCHRM2CHRM3MEN1
SCHEMBL6168606 0.83 OPRL1 (0.52) CHRM2CHRM3MEN1KMT2ADRD2
SCHEMBL29445321 0.83 OPRL1 (0.52) CHRM2CHRM3MEN1KMT2ADRD2
SCHEMBL6168284 0.82 TACR1 (0.41) CALCRLSLC18A3CHRM3PDE6DMEN1
SCHEMBL8570499 0.82 CHRM3 (0.55) CHRM2CHRM3MEN1KMT2ADRD2
SCHEMBL6168102 0.82 CHRM3 (0.42) CALCRLCHRM3PARP1TACR1DRD2
SCHEMBL8563876 0.81 CHRM3 (0.54) CHRM2CHRM3MEN1KMT2ACHRM1

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-0626373-B1 Quinazolinone derivatives SUMITOMO PHARMA (JP) 1998-12-23 EP disclosed
US-5556860-A ANTIISCHEMIC AGENTS, BRAIN DISORDERS AND BLOOD METAL CONCENTRATIONS AND KIDNEY DISEASE SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 1996-09-17 US disclosed
EP-0626373-A1 Quinazolinone derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1994-11-30 EP disclosed