SCHEMBL4608031

SCHEMBL4608031

OCC1(c2ccccc2)CCCC1Br

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.38
OPRK1 P41145 1/20 0.38
HTT P42858 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
MAOB P27338 2/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
DPP4 P27487 1/20 0.34
HDAC4 P56524 1/20 0.34

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
SCHEMBL6556698 1.00 AKR1C1 (0.38) AKR1C1OPRK1HTTLMNASMN1; SMN2
SCHEMBL10751965 0.75 SLC6A4 (0.44) OPRK1MAPT
SCHEMBL28257086 0.73 KDM1A (0.44) AKR1C1OPRK1MAOBDPP4
SCHEMBL11248709 0.69 HSD11B1 (0.45) AKR1C1HTTLMNAHDAC4
SCHEMBL10743036 0.67 SIGMAR1 (0.42) HTTLMNASMN1; SMN2
SCHEMBL10691957 0.67 CHRNB2 (0.41) OPRK1
SCHEMBL11086077 0.67 OPRK1 (0.55) OPRK1MAOBGAA
SCHEMBL9950472 0.67 OPRK1 (0.55) OPRK1MAOBGAA
SCHEMBL2119239 0.67 OPRK1 (0.55) OPRK1MAOBGAA
SCHEMBL11244360 0.66 LMNA (0.41) AKR1C1HTTLMNASMN1; SMN2RAB9A

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
EP-1390072-A2 USE OF AN AMPA RECEPTOR POTENTIATOR FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF TYPE 2 DIABETES ELI LILLY AND COMPANY (US) 2004-02-25 EP disclosed
US-6639107-B1 Potentiating glutamate receptor function ELI LILLY AND COMPANY 2003-10-28 US disclosed
WO-2002089848-A2 USE OF AN AMPA RECEPTOR POTENTIATOR FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF TYPE 2 DIABETES ELI LILLY AND COMPANY (US) 2002-11-14 WO 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