SCHEMBL10723256

SCHEMBL10723256

CCCCCCCCC=CCCCCCCCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)CO

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 4/20 0.47
▸ KCNK3 O14649 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ FAAH O00519 3/20 0.43
▸ APLNR P35414 1/20 0.42
▸ DEGS1 O15121 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ SLC6A5 Q9Y345 1/20 0.41
▸ CETP P11597 1/20 0.40
▸ LPAR3 Q9UBY5 1/20 0.40
▸ CNR1 P21554 2/20 0.39

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
SCHEMBL10723855 1.00 CNR2 (0.47) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL10723247 1.00 CNR2 (0.47) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL10723317 0.91 DEGS1 (0.44) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL10723306 0.91 DEGS1 (0.44) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL10728359 0.90 FAAH (0.53) FAAHAPLNRSMN1; SMN2SLC6A5LPAR3
SCHEMBL10728366 0.90 FAAH (0.53) FAAHAPLNRSMN1; SMN2SLC6A5LPAR3
SCHEMBL10728822 0.90 FAAH (0.53) FAAHAPLNRSMN1; SMN2SLC6A5LPAR3
SCHEMBL10726064 0.89 FAAH (0.43) CNR2FAAHAPLNRSMN1; SMN2SLC6A5
SCHEMBL10723217 0.89 FAAH (0.43) CNR2FAAHAPLNRSMN1; SMN2SLC6A5
SCHEMBL10723233 0.89 FAAH (0.43) CNR2FAAHAPLNRSMN1; SMN2SLC6A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4665053-A HYDROPHOBIC CARBOXYLIC MODIFIER CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1987-05-12 — — US claimed
EP-0126009-B1 PEPTIDE DERIVATIVES, THEIR PREPARATION AND USE AS ELASTASE INHIBITORS Etablissement Public dit: CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 1987-01-14 — — EP claimed
US-4665053-A HYDROPHOBIC CARBOXYLIC MODIFIER CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1987-05-12 — — US disclosed
EP-0126009-B1 PEPTIDE DERIVATIVES, THEIR PREPARATION AND USE AS ELASTASE INHIBITORS Etablissement Public dit: CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 1987-01-14 — — EP disclosed
EP-0126009-A1 Peptide derivatives, their preparation and use as elastase inhibitors Etablissement Public dit: CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 1984-11-21 — — EP disclosed
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