SCHEMBL9824487

SCHEMBL9824487

CCOC(=O)c1c(Sc2ccccc2)n(N(C)C=O)c2cc(F)c(F)cc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 3/20 0.38
MEN1 O00255 2/20 0.37
ALOX5 P09917 1/20 0.37
PKM P14618 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
CASP1 P29466 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RECQL P46063 1/20 0.37
ENPP2 Q13822 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 2/20 0.36
TP53 P04637 1/20 0.35
THRB P10828 1/20 0.35
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35

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
SCHEMBL9823988 0.86 KMT2A (0.44) KMT2AKDM4EMEN1PKMALDH1A1
SCHEMBL9824096 0.74 KDM4E (0.43) KMT2AKDM4EMEN1ALOX5ALDH1A1
SCHEMBL10385637 0.71 ALDH1A1 (0.52) KMT2AKDM4EMEN1PKMALDH1A1
SCHEMBL9824803 0.71 KDM4E (0.43) KMT2AKDM4EMEN1ALOX5ALDH1A1
SCHEMBL9824468 0.71 ENPP2 (0.42) KDM4EALOX5ALDH1A1HPGDALOX15
SCHEMBL9209414 0.71 GRK6 (0.39) KMT2AMEN1ALOX5ENPP2SMN1; SMN2
SCHEMBL10577525 0.71 GAA (0.41) KMT2AKDM4EMEN1ALOX5ALDH1A1
SCHEMBL9824589 0.70 KDM4E (0.40) KDM4EALDH1A1HPGDALOX15TSHR
SCHEMBL10576893 0.70 KDM4E (0.39) KDM4EALDH1A1HPGDALOX15TSHR
SCHEMBL10575865 0.70 KDM4E (0.39) KDM4EALDH1A1HPGDALOX15TSHR

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-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