SCHEMBL6166317

SCHEMBL6166317

CC(=O)N1CCN(C(=O)[CH]Cc2ccc(OC(N)=O)cc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.42
HRH3 Q9Y5N1 2/20 0.40
KMT2A Q03164 5/20 0.39
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 4/20 0.39
MAPT P10636 6/20 0.39
KDM4E B2RXH2 4/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
DRD3 P35462 1/20 0.39
GFER P55789 3/20 0.38
CASP6 P55212 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
GAA P10253 3/20 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
SCHEMBL6164707 0.84 CYP1A2 (0.45) KMT2AALDH1A1MEN1MAPTKDM4E
SCHEMBL6160629 0.80 DPP4 (0.40) KMT2AMEN1HSP90AA1
SCHEMBL7364168 0.79 PRSS1 (0.40) GAALMNA
SCHEMBL7369342 0.78 TEAD1 (0.39) KMT2AALDH1A1MEN1GAALMNA
SCHEMBL7371853 0.71 LTA4H (0.54) HRH3HTTPOLBL3MBTL1
SCHEMBL9566622 0.69 ALDH1A1 (0.53) KMT2AALDH1A1MEN1MAPTKDM4E
SCHEMBL4420267 0.68 ITGB3 (0.50)
SCHEMBL6161203 0.68 MAPK1 (0.40) KMT2AALDH1A1MEN1MAPTSMN1; SMN2
SCHEMBL4086461 0.68 ADRB2 (0.41) KMT2AALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL27711611 0.67 POLB (0.58) KMT2AALDH1A1MEN1CYP3A4PKM

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
EP-1134213-B1 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER (US) 2005-11-02 EP disclosed
EP-0832065-B1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER (US) 2001-10-10 EP disclosed
EP-1134213-A2 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER INC. (US) 2001-09-19 EP disclosed
US-6277877-B1 GLYCOGEN PHOSPHORYLASE INHIBITOR; ANTIDIABETIC AGENTS PFIZER, INC. 2001-08-21 US disclosed
US-6107329-A HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS PFIZER, INC. (US) 2000-08-22 US disclosed
WO-1996039384-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER, INC. (US) 1996-12-12 WO disclosed