SCHEMBL9755787

SCHEMBL9755787

CCc1c(OC)cc(C(N)=O)c(OC)c1CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.42
ALDH1A1 P00352 4/20 0.42
HTT P42858 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPK10 P53779 1/20 0.42
POLB P06746 2/20 0.41
TSHR P16473 1/20 0.41
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
NCOA1 Q15788 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
BPTF Q12830 1/20 0.40
HMGCR P04035 1/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 2/20 0.40
LMNA P02545 3/20 0.39
GAA P10253 2/20 0.39
PTGS2 P35354 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL27527024 0.87 KDM4E (0.42) KDM4EALDH1A1HTTMEN1KMT2A
SCHEMBL27856953 0.87 KDM4E (0.45) KDM4EALDH1A1HTTMEN1KMT2A
SCHEMBL7792129 0.83 LCK (0.42) KDM4EALDH1A1HTTTSHRAPOBEC3A
SCHEMBL1260575 0.81 HMGCR (0.41) KDM4EALDH1A1HTTMEN1KMT2A
SCHEMBL28393333 0.79 ALDH1A1 (0.37) KDM4EALDH1A1HTTMEN1KMT2A
SCHEMBL5482060 0.78 NCOA1 (0.38) KDM4EALDH1A1HTTMEN1KMT2A
SCHEMBL28921381 0.77 KDM4E (0.56) KDM4EALDH1A1HTTMEN1KMT2A
SCHEMBL3342389 0.77 HMGCR (0.50) KDM4EALDH1A1HTTKMT2AHMGCR
SCHEMBL7799274 0.77 PTPN1 (0.41) KDM4EALDH1A1HTTMEN1KMT2A
Acetic Acid SCHEMBL5925567 0.76 HTR4 (0.51) KDM4EALDH1A1HTTTSHRLMNA

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
WO-1991019725-A2 HETEROCYCLIC ANTHRACYCLIONE AND ANTHRACYCLINE ANALOGS BIOCHEM PHARMA INC. (CA) 1991-12-26 WO disclosed