SCHEMBL8628323

SCHEMBL8628323

CSSP(=O)(O)CC(C)C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 3/20 0.33
LAP3 P28838 2/20 0.33
ERAP1 Q9NZ08 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.31
MMP1 P03956 1/20 0.31
MMP8 P22894 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
SCHEMBL8629462 0.80
SCHEMBL8625628 0.72
SCHEMBL331485 0.68
SCHEMBL331939 0.68 ANPEP (0.42) ANPEPLAP3ERAP1TRPM8MMP1
Hydrochloric Acid SCHEMBL28552052 0.66 ANPEP (0.40) ANPEPLAP3ERAP1TRPM8MMP1
Hydrochloric Acid SCHEMBL11333234 0.66 ANPEP (0.46) ANPEPLAP3ERAP1TRPM8MMP1
SCHEMBL28725320 0.66 ANPEP (0.40) ANPEPLAP3ERAP1TRPM8MMP1
SCHEMBL2253835 0.66 ANPEP (0.40) ANPEPLAP3ERAP1TRPM8MMP1
SCHEMBL31074941 0.66 ANPEP (0.40) ANPEPLAP3ERAP1TRPM8MMP1
SCHEMBL29265277 0.66 ANPEP (0.40) ANPEPLAP3ERAP1TRPM8MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35754-E FOR TREATING BACTERIAL INFECTIONS HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-24 US disclosed
US-5710146-A ANTIBIOTICS FOR BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1998-01-20 US disclosed
US-5089490-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
US-4758556-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-19 US disclosed
US-4399131-A Cephem derivatives HOECHST AG (DE) 1983-08-16 US disclosed
US-4278793-A ANTIBIOTICS, BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-14 US disclosed