SCHEMBL21574498

SCHEMBL21574498

COC(=O)COc1c(F)ccc(C)c1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
KMT2A Q03164 2/20 0.40
PTGS2 P35354 1/20 0.40
CTSK P43235 1/20 0.39
SYK P43405 1/20 0.39
ACLY P53396 2/20 0.38
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 1/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CXCR1 P25024 2/20 0.37
CXCR2 P25025 2/20 0.37
KCNN4 O15554 1/20 0.36
ATM Q13315 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL17897032 0.83 MGLL (0.46) KMT2AACLYTSHR
SCHEMBL4832334 0.80 SMN1; SMN2 (0.43) KDM4EKMT2APTGS2SYKACLY
SCHEMBL10428803 0.74 KMT2A (0.57) KMT2AMMP1MMP9MMP8LMNA
SCHEMBL22701125 0.73 NQO1 (0.36) KDM4EALDH1A1HSD17B10MAPTCYP1A2
SCHEMBL14012356 0.73 ALDH1A1 (0.46) KDM4EKMT2ALMNAALDH1A1MAPT
SCHEMBL20607419 0.72 KMT2A (0.47) KDM4EKMT2AMMP1MMP9MMP8
SCHEMBL15517469 0.71 LMNA (0.53) KDM4EKMT2APTGS2MMP1MMP9
SCHEMBL13104128 0.71 LMNA (0.53) KDM4EKMT2ALMNAALDH1A1HSD17B10
SCHEMBL257259 0.70 MEP1B (0.38) KDM4EALDH1A1
SCHEMBL29463962 0.70 MEP1B (0.38) KDM4EALDH1A1

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-3569229-A1 PROPHYLACTIC AND/OR THERAPEUTIC AGENT FOR DISEASES ASSOCIATED WITH AMPA RECEPTORS Public University Corporation Yokohama City University (JP) 2019-11-20 EP disclosed