Decanoic Acid

Decanoic Acid

SCHEMBL30909239

C1=C(c2csc3ccc(Sc4ccccn4)cc23)CCC2CCCCN2C1.CCCCCCCCCC(=O)O

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.33
HRH3 Q9Y5N1 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRK1 P41145 1/20 0.31
GCK P35557 1/20 0.31
P2RY12 Q9H244 1/20 0.30

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
Decanoic Acid SCHEMBL30909160 0.79 HTR1F (0.36) GCK
SCHEMBL30909135 0.74 HCRTR1 (0.39) HRH3OPRK1
SCHEMBL35211302 0.72 HRH3 (0.32) HRH3
Decanoic Acid SCHEMBL30908925 0.71 DRD2 (0.38) OPRM1OPRK1
Decanoic Acid SCHEMBL8427995 0.71 DRD2 (0.38) OPRM1OPRK1
SCHEMBL30908873 0.71 HRH3 (0.39) HRH3OPRM1OPRK1
SCHEMBL30909167 0.70 HRH3 (0.38) HRH3OPRM1OPRK1
SCHEMBL35210767 0.67 TDP1 (0.41) HRH3OPRM1OPRK1
SCHEMBL30909146 0.67 OPRM1 (0.36) HRH3OPRM1OPRK1
SCHEMBL7482649 0.64 GCK (0.35) GCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024073845-A1 METHODS AND PHARMACOLOGICAL AGENTS FOR INCREASING EXPANSION, ENGRAFTMENT OR IMMUNE OUTPUT OF HUMAN HEMATOPOIETIC STEM CELLS IN TRANSPLANTATION AND DISEASE SETTINGS VALORISATION HSJ, LIMITED PARTNERSHIP (CA) 2024-04-11 WO disclosed