SCHEMBL6967580

SCHEMBL6967580

CCC(=O)N(CC)C1CCNCC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 12/20 0.52
SLC6A2 P23975 11/20 0.52
SLC6A3 Q01959 7/20 0.52
KCNH2 Q12809 3/20 0.52
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 1/20 0.37
OPRM1 P35372 1/20 0.36
TACR1 P25103 2/20 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
SCHEMBL13069827 0.86 L3MBTL1 (0.45) SLC6A4SLC6A2SLC6A3KCNH2L3MBTL1
SCHEMBL6969342 0.85 SLC6A4 (0.47) SLC6A4SLC6A2SLC6A3KCNH2L3MBTL1
SCHEMBL9144078 0.85 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3KCNH2OPRM1
SCHEMBL1290745 0.84 SLC6A4 (0.42) SLC6A4SLC6A2SLC6A3KCNH2L3MBTL1
SCHEMBL23487077 0.84 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3KCNH2OPRM1
SCHEMBL4610590 0.84 SLC6A2 (0.49) SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL5255389 0.84 SLC6A4 (0.40) SLC6A4SLC6A2SLC6A3KCNH2L3MBTL1
SCHEMBL297266 0.82 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3KCNH2L3MBTL1
SCHEMBL1309394 0.82 SLC6A4 (0.43) SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL6392802 0.82 L3MBTL1 (0.54) L3MBTL1MEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023224963-A1 DUAL-ACTING ANGIOTENSIN AND ENDOTHELIN RECEPTOR ANTAGONISTS ARIA PHARMACEUTICALS, INC. (US) 2023-11-23 WO disclosed
EP-0897913-B1 4-carboxamido piperidine derivatives and their use as neurokinine antagonists ASTRAZENECA AB (SE) 2003-04-16 EP disclosed
EP-0667858-B1 4-CARBOXOAMIDO PIPERIDINE DERIVATIVES, INTERMEDIATES AND USE AS NEUROKININ ANTAGONISTS ZENECA LTD (GB) 1999-08-25 EP disclosed
EP-0897913-A1 4-carboxamido piperidine derivatives and their use as neurokinine antagonists ZENECA LIMITED (GB) 1999-02-24 EP disclosed
US-5576333-A ASTHMA TREATMENT ZENECA LIMITED (GB) 1996-11-19 US disclosed
US-5559131-A ANTAGONISTS OF TACHYKININS AT THE NEUROKININ 2 RECEPTOR, ANTIASTHMA ZENECA LIMITED (GB) 1996-09-24 US disclosed
US-5559132-A ANTAGONIST OF TACHYKININS AT THE NEUROKININ 2 RECEPTOR, ANTIASTHMA ZENECA LIMITED (GB) 1996-09-24 US disclosed
EP-0667858-A1 4-CARBOXOAMIDO PIPERIDINE DERIVATIVES, INTERMEDIATES AND USE AS NEUROKININ ANTAGONISTS ZENECA LIMITED (GB) 1995-08-23 EP disclosed
US-5391556-A Thrombin inhibitors KARL THOMAE GMBH (DE) 1995-02-21 US disclosed
CN-1094723-A Carboxamide derivative ZENECA LTD (GB) 1994-11-09 CN disclosed
WO-1994010146-A1 4-CARBOXOAMIDO PIPERIDINE DERIVATIVES, INTERMEDIATES AND USE AS NEUROKININ ANTAGONISTS ZENECA LIMITED (GB) 1994-05-11 WO disclosed