SCHEMBL9834684

SCHEMBL9834684

Cc1ncc(CO)c(C=CC(=O)O)c1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.65
ALDH1A1 P00352 7/20 0.65
LMNA P02545 5/20 0.65
HPGD P15428 4/20 0.65
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
AOX1 Q06278 1/20 0.65
TRIM24 O15164 1/20 0.63
TRIM33 Q9UPN9 1/20 0.63
PDXK O00764 1/20 0.60
HSD17B10 Q99714 1/20 0.50
HTT P42858 5/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
MAPT P10636 3/20 0.49
GAA P10253 3/20 0.49
TDP1 Q9NUW8 2/20 0.49
POLB P06746 1/20 0.49
THRB P10828 1/20 0.49
APEX1 P27695 1/20 0.49

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
SCHEMBL9834681 1.00 KDM4E (0.65) KDM4EALDH1A1LMNAHPGDMEN1
SCHEMBL3442736 0.83 KDM4E (0.58) KDM4EALDH1A1LMNAHPGDMEN1
SCHEMBL3442735 0.83 KDM4E (0.58) KDM4EALDH1A1LMNAHPGDMEN1
Hydrochloric Acid SCHEMBL9836549 0.82 TRIM24 (0.59) KDM4EALDH1A1LMNAHPGDMEN1
Hydrochloric Acid SCHEMBL9836547 0.82 TRIM24 (0.59) KDM4EALDH1A1LMNAHPGDMEN1
Pyridoxal SCHEMBL29906 0.79 KDM4E (1.00) KDM4EALDH1A1LMNAHPGDMEN1
Pyridoxal SCHEMBL5934767 0.78 KDM4E (0.82) KDM4EALDH1A1LMNAHPGDMEN1
Pyridoxal SCHEMBL8533734 0.78 KDM4E (0.97) KDM4EALDH1A1LMNAHPGDMEN1
Pyridoxal SCHEMBL5416120 0.78 KDM4E (0.97) KDM4EALDH1A1LMNAHPGDMEN1
Pyridoxal SCHEMBL50601 0.78 TRIM24 (1.00) KDM4EALDH1A1LMNAHPGDMEN1

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-0210782-B1 PYRIDINE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Dainippon Pharmaceutical Co., Ltd. (JP) 1991-04-17 EP disclosed
US-4778796-A ω-(3-pyridyl)alkenamide derivatives and anti-allergenic pharmaceutical compositions containing same DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1988-10-18 US disclosed
EP-0210782-A2 Pyridine compounds, process for the preparation thereof and pharmaceutical composition containing the same Dainippon Pharmaceutical Co., Ltd. (JP) 1987-02-04 EP disclosed