SCHEMBL6607172

SCHEMBL6607172

CCCCC(C(=O)O)c1ncco1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.42
CES1 P23141 1/20 0.42
CA2 P00918 1/20 0.37
MAPK1 P28482 1/20 0.37
CTSA P10619 6/20 0.35
LMNA P02545 1/20 0.35
ALOX5 P09917 2/20 0.35
PPARG P37231 2/20 0.35
PPARA Q07869 2/20 0.35
POLB P06746 1/20 0.34
PTGES O14684 1/20 0.34

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
SCHEMBL28475689 0.90 FAAH (0.38) FAAHCES1CTSA
SCHEMBL1827574 0.83 FAAH (0.36) FAAHCES1CTSA
SCHEMBL9452948 0.81 CTSA (0.38) CTSALMNAALOX5PPARGPPARA
SCHEMBL4328044 0.77 MEN1 (0.32) FAAHCES1CTSA
SCHEMBL4327553 0.76 CTSA (0.41) CTSA
SCHEMBL31366797 0.75 CA2 (0.37) CA2MAPK1LMNAALOX5PPARG
SCHEMBL9452969 0.74 CYP1A2 (0.40) CTSALMNA
SCHEMBL14764834 0.73 FAAH (0.36) FAAHCES1
SCHEMBL22610222 0.73 MAPK1 (0.41) CA2MAPK1ALOX5PPARGPPARA
SCHEMBL5504563 0.73 SLC2A1 (0.37) FAAHCES1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1373264-A1 3-HETEROCYCLYLPROPANOHYDROXAMIC ACID AS PROCOLLAGEN C-PROTEINASE INHIBITORS Pfizer Limited (GB) 2004-01-02 EP disclosed
WO-2002079200-A1 3-HETEROCYCLYLPROPANOHYDROXAMIC ACID AS PROCOLLAGEN C-PROTEINASE INHIBITORS PFIZER LIMITED (GB) 2002-10-10 WO disclosed