SCHEMBL7010447

SCHEMBL7010447

CCOC(=O)C(F)C(=O)c1cc(F)c(Br)c(OCF)c1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
NCOA1 Q15788 1/20 0.30
NCOA3 Q9Y6Q9 1/20 0.30
TSHR P16473 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL10516761 0.87 CA12 (0.34) ALDH1A1L3MBTL1
SCHEMBL7007713 0.86 MEN1 (0.37) LMNAALDH1A1GAASMN1; SMN2NPSR1
SCHEMBL7004956 0.83 ALDH1A1 (0.35) LMNAALDH1A1TSHRL3MBTL1
SCHEMBL10510642 0.78 CES2 (0.46) LMNAALDH1A1NPSR1TSHRL3MBTL1
SCHEMBL6184304 0.76 HSD17B2 (0.40) LMNAALDH1A1TSHRL3MBTL1
SCHEMBL8735860 0.75 MEN1 (0.38) LMNAALDH1A1GAASMN1; SMN2NPSR1
SCHEMBL7005407 0.74 ALDH1A1 (0.41) ALDH1A1GAASMN1; SMN2NPSR1TSHR
SCHEMBL3190052 0.74 CES2 (0.39) ALDH1A1L3MBTL1
SCHEMBL10830983 0.73 CES2 (0.47) ALDH1A1GAASMN1; SMN2TSHRL3MBTL1
SCHEMBL9046842 0.72 CES2 (0.37) LMNASMN1; SMN2TSHRL3MBTL1

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-0775702-B1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO LTD (JP) 2003-07-23 EP disclosed
US-5935952-A ANTIBACTERIAL AGENT TOYAMA CHEMICAL CO., LTD. (JP) 1999-08-10 US disclosed
EP-0775702-A1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 1997-05-28 EP disclosed