SCHEMBL7140786

SCHEMBL7140786

c1ccc2c(COc3ccc(OCCN4CCCC4)cc3)cccc2c1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 10/20 0.62
GCGR P47871 2/20 0.61
BCHE P06276 3/20 0.60
CNR1 P21554 3/20 0.60
CNR2 P34972 3/20 0.60
HTT P42858 1/20 0.55
PTPN1 P18031 2/20 0.54

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
SCHEMBL7136168 0.81 LTA4H (0.65) LTA4HHTT
SCHEMBL7140961 0.81 MCHR1 (0.73) LTA4HHTT
SCHEMBL7135488 0.81 MCHR1 (0.73) LTA4HHTT
SCHEMBL10349749 0.81 PARP10 (0.71) LTA4HCNR1CNR2
SCHEMBL7134913 0.77 LTA4H (0.69) LTA4HHTT
SCHEMBL2476820 0.77 LTA4H (1.00) LTA4HHTT
SCHEMBL7137996 0.77 KCNH2 (0.75) LTA4HBCHECNR1CNR2HTT
SCHEMBL255201 0.76 LTA4H (0.86) LTA4H
SCHEMBL5609808 0.76 NPC1 (0.64) CNR1CNR2
SCHEMBL20748052 0.76 LTA4H (0.97) LTA4HHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6506876-B1 LTA4 hydrolase inhibitor pharmaceutical compositions and methods of use G.D. SEARLE & CO. 2003-01-14 US disclosed
EP-0804427-B1 LTA4 HYDROLASE INHIBITORS SEARLE & CO (US) 2002-09-18 EP disclosed
EP-1221441-A2 LTA4 Hydrolase inhibitors G.D. SEARLE & CO. (US) 2002-07-10 EP disclosed
US-5723492-A LTA4 hydrolase inhibitor pharmaceutical compositions and methods of use G.D. SEARLE & CO. (US) 1998-03-03 US disclosed
US-5719306-A ANTIINFLAMMATORY AGENTS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed
EP-0804427-A1 LTA4 HYDROLASE INHIBITORS G.D. SEARLE & CO. (US) 1997-11-05 EP disclosed
EP-0786992-A2 LTA 4? HYDROLASE INHIBITOR PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE G.D. SEARLE & CO. (US) 1997-08-06 EP disclosed
US-5585492-A USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES WHICH ARE MEDIATED BY LTB4 PRODUCTION, SUCH AS PSORIASIS, ULCERATIVE COLITIS, IRRITABLE BOWEL DISEASE AND ASTHMA G. D. SEARLE & CO. (US) 1996-12-17 US disclosed
WO-1996010999-A2 LTA4 HYDROLASE INHIBITOR PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE G.D. SEARLE & CO. (US) 1996-04-18 WO disclosed
WO-1996011192-A1 LTA4 HYDROLASE INHIBITORS G.D. SEARLE & CO. (US) 1996-04-18 WO disclosed