SCHEMBL4604973

SCHEMBL4604973

COc1ccc(-c2ccc(C3CCCC3N)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 8/20 0.61
MAOB P27338 3/20 0.61
MAOA P21397 2/20 0.61
HTR2C P28335 1/20 0.45
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ESR2 Q92731 1/20 0.40
NOS3 P29474 2/20 0.39
NOS1 P29475 2/20 0.39
NOS2 P35228 2/20 0.39

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
SCHEMBL4266648 0.95 KDM1A (0.67) KDM1AMAOBMAOAHTR2CNOS3
SCHEMBL4266649 0.95 KDM1A (0.67) KDM1AMAOBMAOAHTR2CNOS3
SCHEMBL4257207 0.91 KDM1A (0.67) KDM1AMAOBMAOAHTR2C
SCHEMBL4257203 0.91 KDM1A (0.67) KDM1AMAOBMAOAHTR2C
SCHEMBL4608227 0.80 KDM1A (0.40) KDM1AMAOBMAOA
SCHEMBL4606554 0.79 KDM1A (0.66) KDM1AMAOBMAOAHTR2CNPC1
SCHEMBL4604971 0.77 SLC6A2 (0.52) KDM1AMAOBMAOAHTR2CNPC1
SCHEMBL7094099 0.76 KDM1A (1.00) KDM1AMAOBMAOAHTR2C
SCHEMBL6755876 0.76 KDM1A (1.00) KDM1AMAOBMAOAHTR2C
SCHEMBL5729043 0.76 KDM1A (1.00) KDM1AMAOBMAOAHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1246797-B1 CYCLOPENTYL SULFONAMIDE DERIVATIVES LILLY CO ELI (US) 2008-07-23 EP claimed
US-6639107-B1 Potentiating glutamate receptor function ELI LILLY AND COMPANY 2003-10-28 US claimed
EP-1246797-A1 CYCLOPENTYL SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-10-09 EP claimed
WO-2001042203-A1 CYCLOPENTYL SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2001-06-14 WO claimed
EP-1246797-B1 CYCLOPENTYL SULFONAMIDE DERIVATIVES LILLY CO ELI (US) 2008-07-23 EP disclosed