SCHEMBL10636627

SCHEMBL10636627

CC(=O)SCC1COCO1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL31650790 0.86
Acetic Acid SCHEMBL10396253 0.72 ALDH1A1 (0.32) ALDH1A1
SCHEMBL20057211 0.70 ACE (0.33) ACE
SCHEMBL2480903 0.69 KMT2A (0.46) ALDH1A1
SCHEMBL1870099 0.69 MTNR1A (0.47) ALDH1A1
SCHEMBL9724896 0.69 ALDH1A1 (0.50) ALDH1A1
SCHEMBL2483233 0.69 ACE (0.35) ACE
SCHEMBL22067570 0.68 ALDH1A1 (0.34) ALDH1A1
SCHEMBL10423871 0.68 CA2 (0.44) ACEALDH1A1
SCHEMBL2483886 0.68 KMT2A (0.41) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0138538-B1 2-DIOXACYCLOALKYLTHIOPENEM DERIVATIVES PFIZER INC. (US) 1988-12-14 EP disclosed
US-4614737-A ANTIBIOTICS PFIZER INC. (US) 1986-09-30 US disclosed
EP-0138538-A1 2-Dioxacycloalkylthiopenem derivatives PFIZER INC. (US) 1985-04-24 EP disclosed