SCHEMBL7792820

SCHEMBL7792820

CCCC[Sn](CCCC)(CCCC)C1=CCC(C(C)(C)C)CC1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.34
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 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
SCHEMBL8196111 0.72
SCHEMBL238978 0.67
SCHEMBL6311512 0.67
SCHEMBL1358657 0.66 ALDH1A1 (0.34) ALDH1A1RAB9A
SCHEMBL9596829 0.65 ALDH1A1 (0.33) ALDH1A1RAB9A
SCHEMBL7834163 0.65 TSHR (0.33) LMNA
SCHEMBL31545085 0.64 LMNA (0.70) CES2LMNA
SCHEMBL520941 0.64
SCHEMBL623051 0.64 MAPK1 (0.35)
SCHEMBL9706627 0.63 LMNA (0.47) CES2LMNAALDH1A1RAB9A

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-0592677-B1 Beta-LACTAM COMPOUND AND CEPHEM COMPOUND, AND PRODUCTION THEREOF OTSUKA KAGAKU KK (JP) 2001-11-07 EP disclosed
US-5693792-A INTERMEDIATES FOR CEPHALOSPORIN ANTIBIOTICS OTSUGA KAGAKU KABUSHIKI KAISHA (JP) 1997-12-02 US disclosed
US-5470972-A Process for preparing examethylenecephem compounds OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1995-11-28 US disclosed
EP-0592677-A1 Beta-LACTAM COMPOUND AND CEPHEM COMPOUND, AND PRODUCTION THEREOF OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1994-04-20 EP disclosed