SCHEMBL7447480

SCHEMBL7447480

COC(=O)C(c1ccc(C(=O)N2CCCC2)cc1)N1CCC(N2CCN(c3ccc(/C(N)=N\O)cc3)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 14/20 0.49
L3MBTL1 Q9Y468 13/20 0.49
MBTD1 Q05BQ5 5/20 0.49
TP53BP1 Q12888 2/20 0.49
L3MBTL4 Q8NA19 2/20 0.49
KDM4E B2RXH2 3/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 2/20 0.45
NPY2R P49146 1/20 0.40
HRH1 P35367 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39

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
SCHEMBL7447486 1.00 L3MBTL3 (0.49) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL7447215 0.90 L3MBTL3 (0.52) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL7497709 0.89 L3MBTL3 (0.53) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL7497716 0.89 L3MBTL3 (0.53) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL7439095 0.89 ITGB3 (0.41) KDM4ETDP1ALDH1A1NPY2RHRH3
SCHEMBL7441958 0.89 KDM4E (0.48) L3MBTL1KDM4ETDP1ALDH1A1NPY2R
SCHEMBL7441963 0.89 KDM4E (0.48) L3MBTL1KDM4ETDP1ALDH1A1NPY2R
SCHEMBL7439098 0.89 ITGB3 (0.41) KDM4ETDP1ALDH1A1NPY2RHRH3
SCHEMBL7436252 0.87 NPY2R (0.49) L3MBTL1KDM4ETDP1ALDH1A1NPY2R
SCHEMBL7436257 0.87 NPY2R (0.49) L3MBTL1KDM4ETDP1ALDH1A1NPY2R

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-0623120-A1 PIPERIDINEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1994-11-09 EP disclosed
WO-1993014077-A1 PIPERIDINEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1993-07-22 WO disclosed