SCHEMBL8430979

SCHEMBL8430979

CC(C)(C)OC(=O)N1CCC(C#COS(C)(=O)=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.47
GPR119 Q8TDV5 9/20 0.46
RECQL P46063 1/20 0.45
EPHX1 P07099 1/20 0.45
KMT2A Q03164 1/20 0.43
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
STS P08842 3/20 0.42

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
SCHEMBL6451175 0.81 GPR119 (0.43) HPGDGPR119RECQLEPHX1KMT2A
SCHEMBL12820311 0.80 HPGD (0.53) HPGDGPR119RECQLEPHX1USP2
SCHEMBL6450758 0.79 GPR119 (0.43) HPGDGPR119RECQLEPHX1STS
SCHEMBL15203221 0.79 HPGD (0.51) HPGDGPR119RECQLEPHX1USP2
SCHEMBL31586656 0.78 HPGD (0.50) HPGDGPR119RECQLEPHX1KMT2A
SCHEMBL29059714 0.78 HPGD (0.50) HPGDGPR119RECQLEPHX1USP2
SCHEMBL311155 0.77 HPGD (0.55) HPGDGPR119RECQLEPHX1KMT2A
SCHEMBL4052689 0.77 HPGD (0.55) HPGDGPR119RECQLEPHX1USP2
SCHEMBL12376562 0.77 HPGD (0.49) HPGDGPR119RECQLEPHX1USP2
SCHEMBL6456079 0.77 HPGD (0.49) HPGDGPR119RECQLEPHX1USP2

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
US-5877321-A NEUROKININ RECEPTOR SANOFI (FR) 1999-03-02 US disclosed
US-5446052-A Used for treatment of substance p-and neurokinin-dependent pathology such as analgesia and inflmmation SANOFI (FR) 1995-08-29 US disclosed
US-5300648-A Analgesics, antiinflammatory agents SOCIETE ANONYME: ELF SANOFI (FR) 1994-04-05 US disclosed
EP-0512902-A1 Dialkyleneperidino compounds and their enantiomers, process for their preparation and pharmaceutical compositions containing them SANOFI (FR) 1992-11-11 EP disclosed