SCHEMBL9873608

SCHEMBL9873608

COc1ccc(C(=O)N2CCCC2C(O)C(=O)O)cc1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
POLB P06746 2/20 0.47
ALDH1A1 P00352 5/20 0.47
LMNA P02545 1/20 0.46
HSD11B1 P28845 2/20 0.46
CYP2D6 P10635 1/20 0.46
KDM4E B2RXH2 2/20 0.45
ROCK2 O75116 1/20 0.45
CYP2C19 P33261 1/20 0.44
MAPK1 P28482 1/20 0.44
HPGD P15428 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA7 P43166 1/20 0.44
TPMT P51580 1/20 0.44

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
SCHEMBL9873616 1.00 MEN1 (0.49) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL9874216 0.87 GAA (0.49) KMT2APOLBALDH1A1LMNAKDM4E
SCHEMBL9874208 0.87 GAA (0.49) KMT2APOLBALDH1A1LMNAKDM4E
SCHEMBL9875176 0.84 ALDH1A1 (0.50) POLBALDH1A1LMNAHSD11B1HPGD
SCHEMBL9875180 0.84 ALDH1A1 (0.50) POLBALDH1A1LMNAHSD11B1HPGD
SCHEMBL15595714 0.80 ALDH1A1 (0.58) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL8190806 0.80 ALDH1A1 (0.58) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL8190808 0.80 ALDH1A1 (0.58) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL21696876 0.80 HPGD (0.61) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL9872738 0.80 GAA (0.47) MEN1KMT2AALDH1A1KDM4EHPGD

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
US-5051444-A Pyrrolidine derivatives as anti-amnesia agents SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1991-09-24 US disclosed
US-4880827-A Pyrrolidine derivatives having inhibitory action for proline specific endopepidase SUMITOMO PHARMACEUTICALS COMPANY, LTD. (JP) 1989-11-14 US disclosed
EP-0238319-A1 Pyrrolidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-09-23 EP disclosed