SCHEMBL4306408

SCHEMBL4306408

CCCCCCCCCCCCCC(=O)N1CCN(CC)C(C)C1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 9/20 0.53
GNAI1 P63096 9/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
GNAO1 P09471 8/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CHRM1 P11229 1/20 0.43
NAAA Q02083 2/20 0.40
FAAH O00519 1/20 0.40

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
SCHEMBL4304325 1.00 GNAI3 (0.53) GNAI3GNAI1L3MBTL1GNAO1MEN1
SCHEMBL4308322 1.00 GNAI3 (0.53) GNAI3GNAI1L3MBTL1GNAO1MEN1
SCHEMBL4308311 1.00 GNAI3 (0.53) GNAI3GNAI1L3MBTL1GNAO1MEN1
SCHEMBL4300859 0.85 GNAI3 (0.47) GNAI3GNAI1L3MBTL1GNAO1MEN1
SCHEMBL4304323 0.83 MEN1 (0.55) GNAI3GNAI1L3MBTL1GNAO1MEN1
SCHEMBL4308949 0.81 CHRM1 (0.49) GNAI3GNAI1MAPTCHRM1
SCHEMBL4307522 0.81 CHRM1 (0.49) GNAI3GNAI1MAPTCHRM1
SCHEMBL8972813 0.78 L3MBTL1 (0.80) GNAI3GNAI1L3MBTL1GNAO1MEN1
SCHEMBL4450061 0.78 L3MBTL1 (0.80) GNAI3GNAI1L3MBTL1GNAO1MEN1
SCHEMBL8972823 0.78 L3MBTL1 (0.80) GNAI3GNAI1L3MBTL1GNAO1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2054398-A1 NEW HETEROCYCLIC COMPOUNDS CONTAINING NITROGEN ATOMS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FOR TREATMENT OF CANCER Korea Research Institute of Bioscience and Biotechnology (KR) 2009-05-06 EP claimed
WO-2008018778-A1 NEW HETEROCYCLIC COMPOUNDS CONTAINING NITROGEN ATOMS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FOR TREATMENT OF CANCER KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2008-02-14 WO claimed
EP-2054398-A1 NEW HETEROCYCLIC COMPOUNDS CONTAINING NITROGEN ATOMS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FOR TREATMENT OF CANCER Korea Research Institute of Bioscience and Biotechnology (KR) 2009-05-06 EP disclosed
WO-2008018778-A1 NEW HETEROCYCLIC COMPOUNDS CONTAINING NITROGEN ATOMS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FOR TREATMENT OF CANCER KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2008-02-14 WO disclosed