SCHEMBL6598017

SCHEMBL6598017

CCCCC1CC(=O)N(S)C1=O

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.33
GRM2 Q14416 2/20 0.33
CYP19A1 P11511 4/20 0.32
ALDH1A1 P00352 3/20 0.32
CYP1A2 P05177 1/20 0.32
MMP1 P03956 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 1/20 0.31
MEN1 O00255 4/20 0.31
KMT2A Q03164 4/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL8749735 0.80 CYP2C19 (0.41)
SCHEMBL13003189 0.78 ELANE (0.37) ELANECYP19A1ALDH1A1CYP1A2MEN1
SCHEMBL5690985 0.76 CYP19A1 (0.50) ELANECYP19A1ALDH1A1MEN1KMT2A
SCHEMBL18906449 0.74 CYP1A2 (0.39) CYP19A1ALDH1A1CYP1A2MEN1KMT2A
SCHEMBL1758179 0.73 CYP1A2 (0.38) CYP19A1ALDH1A1CYP1A2MEN1KMT2A
SCHEMBL18499747 0.71 CYP19A1 (0.40) GRM2CYP19A1ALDH1A1CYP1A2MEN1
SCHEMBL9181452 0.71 CYP1A2 (0.40) CYP19A1ALDH1A1CYP1A2MEN1KMT2A
SCHEMBL22963926 0.71 ALDH1A1 (0.37) CYP19A1ALDH1A1CYP1A2MEN1KMT2A
SCHEMBL18499720 0.71 CYP19A1 (0.40) GRM2CYP19A1ALDH1A1CYP1A2MEN1
SCHEMBL27576345 0.71 CYP1A2 (0.40) CYP19A1ALDH1A1CYP1A2MEN1KMT2A

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-1201664-B1 BENZIMIDAZOLE COMPOUNDS AND DRUGS CONTAINING THE SAME FUJI PHOTO FILM CO LTD (JP) 2004-09-08 EP disclosed
US-6593323-B1 Benzimidazole compound inhibitory action of forming of macrophages and is useful as an active ingredient of a medicament for preventive and/or therapeutic treatment of arteriosclerosis, which is represented by the formula (I): FUJI PHOTO FILM CO., LTD. (JP) 2003-07-15 US disclosed
EP-1201664-A1 BENZIMIDAZOLE COMPOUNDS AND DRUGS CONTAINING THE SAME FUJI PHOTO FILM CO., LTD. (JP) 2002-05-02 EP disclosed