SCHEMBL9824173

SCHEMBL9824173

CCOC(=O)c1c(SC)n(-c2ccc(F)cc2F)c2c(Cl)c(F)c(F)cc2c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 3/20 0.39
TSHR P16473 3/20 0.39
KDM4E B2RXH2 3/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CASP1 P29466 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
ALOX5 P09917 1/20 0.36
STAT3 P40763 1/20 0.36
MAPT P10636 3/20 0.34
LMNA P02545 2/20 0.34
GAA P10253 1/20 0.34
PPARG P37231 1/20 0.34
NCOA2 Q15596 1/20 0.34
NCOA1 Q15788 1/20 0.34
PKM P14618 1/20 0.34
CYP1A2 P05177 2/20 0.34

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
SCHEMBL9824753 0.92 MEN1 (0.40) RXFP1ALDH1A1HPGDTSHRKDM4E
SCHEMBL10575881 0.91 ALDH1A1 (0.38) RXFP1ALDH1A1HPGDTSHRKDM4E
SCHEMBL9824934 0.89 ALOX5 (0.38) RXFP1ALDH1A1HPGDTSHRKDM4E
SCHEMBL9824616 0.89 MEN1 (0.43) RXFP1ALDH1A1HPGDTSHRKDM4E
SCHEMBL10577464 0.87 KMT2A (0.38) RXFP1ALDH1A1HPGDTSHRKDM4E
SCHEMBL9824058 0.84 KDM4E (0.42) RXFP1ALDH1A1HPGDTSHRKDM4E
SCHEMBL9824262 0.83 ALDH1A1 (0.38) RXFP1ALDH1A1HPGDTSHRKDM4E
SCHEMBL9824142 0.81 MEN1 (0.46) ALDH1A1HPGDKDM4EKMT2AMEN1
SCHEMBL10578967 0.80 MEN1 (0.42) RXFP1ALDH1A1HPGDTSHRKDM4E
SCHEMBL9824389 0.79 STAT3 (0.44) RXFP1ALDH1A1HPGDTSHRKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0227088-B1 ISOXAZOLO-NAPHTHYRIDINE, ISOXAZOLO QUINOLINE, ISOTHIAZOLONAPHTHYRIDINE, AND ISOTHIAZOLOQUINOLINE DERIVATIVES ABBOTT LABORATORIES (US) 1991-08-07 EP disclosed
US-4880814-A 7-cycloalkyl naphthyridines ABBOTT LABORATORIES (US) 1989-11-14 US disclosed
US-4767762-A Tricyclic quinoline and naphthyride antibacterials ABBOTT LABORATORIES (US) 1988-08-30 US disclosed
EP-0227088-A1 Isoxazolo-naphthyridine, isoxazolo quinoline, isothiazolonaphthyridine, and isothiazoloquinoline derivatives ABBOTT LABORATORIES (US) 1987-07-01 EP disclosed