SCHEMBL7692009

SCHEMBL7692009

CCCCCCCCNC(=O)N1CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.58
NAMPT P43490 2/20 0.56
TDP1 Q9NUW8 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
KDM4E B2RXH2 1/20 0.52
EPHX1 P07099 8/20 0.52
NAAA Q02083 1/20 0.51
EPHX2 P34913 1/20 0.49

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
SCHEMBL8396793 1.00 HTT (0.58) HTTNAMPTTDP1L3MBTL1MEN1
SCHEMBL8394588 1.00 HTT (0.58) HTTNAMPTTDP1L3MBTL1MEN1
SCHEMBL8391321 0.98 HTT (0.60) HTTNAMPTTDP1L3MBTL1MEN1
SCHEMBL8395941 0.98 HTT (0.60) HTTNAMPTTDP1L3MBTL1MEN1
SCHEMBL1474054 0.98 HTT (0.60) HTTNAMPTTDP1L3MBTL1MEN1
SCHEMBL8393260 0.98 HTT (0.60) HTTNAMPTTDP1L3MBTL1MEN1
SCHEMBL8397091 0.96 HTT (0.62) HTTNAMPTTDP1L3MBTL1MEN1
SCHEMBL1681188 0.93 HTT (0.67) HTTNAMPTTDP1L3MBTL1MEN1
SCHEMBL21902726 0.91 HTT (0.52) HTTNAMPTTDP1L3MBTL1MEN1
SCHEMBL24176160 0.91 TDP1 (0.65) HTTNAMPTTDP1L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002006229-A2 HETEROCYCLIC BETA-3 ADRENERGIC RECEPTOR AGONISTS WYETH (US) 2002-01-24 WO disclosed
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US disclosed