SCHEMBL7005285

SCHEMBL7005285

CCOC(=O)CC(=O)c1cc(F)c([N+](=O)[O-])c(C)c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.37
ALDH1A1 P00352 5/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
KDM4E B2RXH2 2/20 0.37
LMNA P02545 4/20 0.37
GAA P10253 2/20 0.37
MAPK1 P28482 2/20 0.37
GALR2 O43603 1/20 0.36
MITF O75030 1/20 0.36
POLB P06746 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HPGD P15428 1/20 0.36
XBP1 P17861 1/20 0.36
CCR6 P51684 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MIF P14174 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 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
SCHEMBL7008342 0.86 ALDH1A1 (0.46) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL3190037 0.82 ALDH1A1 (0.43) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL10391659 0.81 MAPT (0.37) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL10423012 0.80 MAPT (0.47) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7007303 0.79 ALDH1A1 (0.46) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7004953 0.79 ALDH1A1 (0.40) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7010043 0.79 LMNA (0.43) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7009698 0.78 PDGFRB (0.41) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL9049112 0.78 ALDH1A1 (0.38) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL30958584 0.78 ALDH1A1 (0.44) MAPTALDH1A1SMN1; SMN2MEN1KMT2A

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-0945435-B1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT WAKUNAGA PHARMA CO LTD (JP) 2003-08-13 EP disclosed
US-6136823-A BACTERICIDES OR VIRICIDES WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
EP-0945435-A1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP disclosed