SCHEMBL10939699

SCHEMBL10939699

O=C(c1ccccc1)c1ccc(F)cc1OC(F)(F)C(F)(F)Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.43
MAPT P10636 6/20 0.43
MAPK1 P28482 4/20 0.43
KDM4E B2RXH2 3/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
HSD17B10 Q99714 2/20 0.38
ALOX15 P16050 1/20 0.38
ABCC9 O60706 1/20 0.38
ABCC8 Q09428 1/20 0.38
KCNJ11 Q14654 1/20 0.38
KCNJ8 Q15842 1/20 0.38
LMNA P02545 3/20 0.38
HTT P42858 2/20 0.38
TSHR P16473 2/20 0.38
HPGD P15428 2/20 0.38

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
SCHEMBL10935425 0.87 ELANE (0.47) ELANEMAPTMAPK1KDM4EMEN1
SCHEMBL10934437 0.83 MEN1 (0.46) ELANEMAPTMAPK1KDM4EMEN1
SCHEMBL30785050 0.76 ELANE (0.48) ELANEMAPTMAPK1KDM4EGAA
SCHEMBL10935638 0.75 MAPT (0.55) ELANEMAPTMAPK1KDM4EMEN1
SCHEMBL10936326 0.75 MAPT (0.49) ELANEMAPTMAPK1KDM4EMEN1
SCHEMBL10935929 0.74 TP53 (0.46) ELANEMAPTMAPK1GAALMNA
SCHEMBL25902691 0.73 KMT2A (0.54) MAPTMAPK1KDM4EMEN1USP2
SCHEMBL11638597 0.72 MAPT (0.49) MAPTKDM4EMEN1USP2GAA
SCHEMBL10937430 0.72 ELANE (0.57) ELANEMAPTMAPK1GAAALDH1A1
SCHEMBL21486396 0.72 POLB (0.50) ELANEMAPTMAPK1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0085265-B1 PROCESS FOR THE PREPARATION OF ALPHA,ALPHA-DIFLUOROALKOXY OR ALPHA,ALPHA-DIFLUOROALKYLTHIOPHENYL KETONES RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1985-05-22 EP disclosed