SCHEMBL9859889

SCHEMBL9859889

O=C1CCCN1C(CO)=C(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
ALDH1A1 P00352 5/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 4/20 0.40
MEN1 O00255 2/20 0.40
RECQL P46063 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
THRB P10828 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
BLM P54132 1/20 0.40
CYP3A4 P08684 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MITF O75030 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SLC6A2 P23975 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
SCHEMBL9859442 0.77 MAPT (0.40) LMNAALDH1A1HSD17B10MAPTMEN1
SCHEMBL14539264 0.75 MAPT (0.44) LMNAALDH1A1HSD17B10MAPTMEN1
SCHEMBL9860172 0.72 MAPT (0.37) LMNAALDH1A1HSD17B10MAPTMEN1
SCHEMBL9860180 0.72 MAPT (0.37) LMNAALDH1A1HSD17B10MAPTMEN1
SCHEMBL5738542 0.67 ALDH1A1 (0.54) LMNAALDH1A1HSD17B10MAPTMEN1
SCHEMBL9192193 0.67 KMT2A (0.49) LMNAALDH1A1HSD17B10MAPTMEN1
SCHEMBL5182886 0.67 KMT2A (0.75) LMNAALDH1A1HSD17B10MAPTMEN1
SCHEMBL20107836 0.64 LMNA (0.73) LMNAMAPTMEN1RECQLKMT2A
SCHEMBL20491282 0.64 ALDH1A1 (0.48) LMNAALDH1A1HSD17B10MAPTMEN1
SCHEMBL20491281 0.64 ALDH1A1 (0.48) LMNAALDH1A1HSD17B10MAPTMEN1

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-0430129-A2 Novel phenylethylene derivatives, processes for preparing the same and intermediates therefor TANABE SEIYAKU CO., LTD. (JP) 1991-06-05 EP disclosed