SCHEMBL7064442

SCHEMBL7064442

CCCCNC(=O)N([C]=O)CCC

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.42
ACHE P22303 8/20 0.40
MMP2 P08253 2/20 0.40
DNM1 Q05193 1/20 0.38
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
MMP1 P03956 1/20 0.37
CASP2 P42575 1/20 0.36

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
SCHEMBL7684377 0.87 EPHX1 (0.47) EPHX1DNM1CASP2
SCHEMBL5072049 0.85 EPHX1 (0.41) EPHX1ACHEMMP2DNM1MMP1
SCHEMBL6109959 0.82 ALDH1A1 (0.36) MMP2MMP1
SCHEMBL15775180 0.81 EPHX1 (0.40) EPHX1ACHEMMP2TSHRHTT
SCHEMBL29055799 0.76 FAAH (0.44) EPHX1DNM1CASP2
SCHEMBL25230048 0.76 EPHX1 (0.48) EPHX1ACHEMMP2DNM1TSHR
SCHEMBL11221492 0.75 ZDHHC20 (0.47) EPHX1CASP2
SCHEMBL7203744 0.74 EPHX1 (0.41) EPHX1CASP2
SCHEMBL25168921 0.73 EPHX1 (0.45) EPHX1ACHEMMP2DNM1MMP1
SCHEMBL7674452 0.73 FAAH (0.50) DNM1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0901787-B1 Stabilized pharmaceutical composition TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-05-28 EP disclosed