SCHEMBL9065669

SCHEMBL9065669

CC(C)CCCCCOC(=O)CCS.CCCC[Sn]CCCC

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.41
DGKA P23743 1/20 0.41
HTR2C P28335 1/20 0.41
DNM1 Q05193 1/20 0.39
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
MAPT P10636 1/20 0.37
RAD52 P43351 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
FAAH O00519 1/20 0.36
PLA2G2A P14555 2/20 0.36
NOD1 Q9Y239 1/20 0.36
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL9242196 1.00 NAAA (0.41) NAAADGKAHTR2CDNM1PRSS1
SCHEMBL11123854 1.00 NAAA (0.41) NAAADGKAHTR2CDNM1PRSS1
SCHEMBL825637 1.00 NAAA (0.41) NAAADGKAHTR2CDNM1PRSS1
SCHEMBL7719966 0.97 NAAA (0.43) NAAADGKAHTR2CDNM1PRSS1
SCHEMBL338603 0.89 NAAA (0.44) NAAADGKAHTR2CRAD52NPSR1
SCHEMBL11883709 0.89 NAAA (0.44) NAAADGKAHTR2CRAD52NPSR1
SCHEMBL22091877 0.89 NAAA (0.44) NAAADGKAHTR2CRAD52NPSR1
SCHEMBL9068220 0.89 NAAA (0.53) NAAADGKAHTR2CDNM1PRSS1
SCHEMBL8621327 0.89 NAAA (0.53) NAAADGKAHTR2CDNM1PRSS1
SCHEMBL11879854 0.89 NAAA (0.53) NAAADGKAHTR2CDNM1PRSS1

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-0461745-B1 Stabilization and foaming of polyvinylchloride resins WITCO CORP (US) 1996-12-18 EP disclosed
EP-0461745-A1 Stabilization and foaming of polyvinylchloride resins WITCO CORPORATION (US) 1991-12-18 EP disclosed
US-5055495-A Blowing agent and activator comprising a organotin mercapto acid ester and a diorgano tin oxide /ester complex; heat resistance WITCO CORPORATION (US) 1991-10-08 US disclosed
US-4977193-A FOAMING IN PRESENCE OF ORGANOTIN MERCAPTO ACID ESTER WITCO CORPORATION (US) 1990-12-11 US disclosed