SCHEMBL4607515

SCHEMBL4607515

CC(C)(C)c1ccc(C2CCCC2=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
PTGER2 P43116 1/20 0.38
ACHE P22303 1/20 0.37
TNKS O95271 1/20 0.37
TNKS2 Q9H2K2 1/20 0.37
PARP3 Q9Y6F1 1/20 0.37
GAA P10253 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
RAB9A P51151 2/20 0.36
EPHX1 P07099 1/20 0.36
EPHX2 P34913 1/20 0.36
CYP19A1 P11511 1/20 0.35
MAPK1 P28482 1/20 0.35
MAPK14 Q16539 1/20 0.35
MEN1 O00255 2/20 0.35

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
SCHEMBL6519821 0.95 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3DDB1CRBN
SCHEMBL5613574 0.93 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3DDB1CRBN
SCHEMBL719480 0.77 HTR2C (0.42) DDB1CRBNTNKSTNKS2
Hydrochloric Acid SCHEMBL30656513 0.76 HTR2C (0.44) DDB1CRBNTNKSTNKS2
SCHEMBL512106 0.76 SRD5A1 (0.41) SLC6A2SLC6A4SLC6A3ALDH1A1HPGD
SCHEMBL361341 0.76 LMNA (0.43) SLC6A2SLC6A4SLC6A3GAAALDH1A1
SCHEMBL4917555 0.76 LIG1 (0.40) GAACYP19A1MAPK1MEN1KMT2A
SCHEMBL11637205 0.75 DDB1 (0.55) DDB1CRBNALDH1A1HPGDRAB9A
SCHEMBL28745563 0.75 ALDH1A1 (0.44) DDB1CRBNGAAALDH1A1HPGD
SCHEMBL361599 0.75 DDB1 (0.48) DDB1CRBNKMT2AMAPTTSHR

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 6 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 disclosed
US-6639107-B1 Potentiating glutamate receptor function ELI LILLY AND COMPANY 2003-10-28 US disclosed
EP-1246797-A1 CYCLOPENTYL SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-10-09 EP disclosed
WO-2001042203-A1 CYCLOPENTYL SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2001-06-14 WO disclosed
CN-87106830-A TERTIARY AMINE COMPOUND 1988-06-29 CN disclosed
EP-0259977-A2 Tertiary amine compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-03-16 EP disclosed