SCHEMBL7010288

SCHEMBL7010288

CCOC=C(C(=O)OCC)C(=O)c1cc(F)c(F)c(C)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
NPSR1 Q6W5P4 5/20 0.40
LMNA P02545 4/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
GLO1 Q04760 1/20 0.35
S1PR4 O95977 1/20 0.35
S1PR1 P21453 1/20 0.35
MAPK1 P28482 1/20 0.35
DHODH Q02127 3/20 0.34
CYP2D6 P10635 2/20 0.34
CYP3A4 P08684 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HTT P42858 1/20 0.33
GAA P10253 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
PLIN1 O60240 1/20 0.33

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
SCHEMBL9678091 1.00 MAPT (0.40) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL7010284 1.00 MAPT (0.40) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL7054034 0.90 MEN1 (0.41) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL7176844 0.90 MEN1 (0.41) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL5528820 0.90 MEN1 (0.41) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL29733864 0.90 MEN1 (0.41) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL29733801 0.90 NPSR1 (0.39) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL10473856 0.90 NPSR1 (0.39) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL5525144 0.90 NPSR1 (0.39) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL7005347 0.90 NPSR1 (0.39) MAPTMEN1KMT2ANPSR1LMNA

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-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
EP-0237955-B1 QUINOLONECARBOXYLIC ACID DERIVATIVES AND THEIR PREPARATION KYORIN PHARMACEUTICAL CO., LTD. (JP) 1992-07-15 EP disclosed
US-4894458-A BACTERICIDES KYORIN PHARMACEUTICAL CO., LTD. (JP) 1990-01-16 US disclosed
EP-0237955-A2 Quinolonecarboxylic acid derivatives and their preparation KYORIN PHARMACEUTICAL CO., LTD. (JP) 1987-09-23 EP disclosed