SCHEMBL11238246

SCHEMBL11238246

C=C(C)COc1ccc(-c2ccc(OCC(=C)C)cc2F)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 14/20 0.45
MEN1 O00255 12/20 0.45
MAPT P10636 11/20 0.45
NPSR1 Q6W5P4 9/20 0.45
LMNA P02545 6/20 0.45
ALOX12 P18054 2/20 0.45
MAPK1 P28482 5/20 0.44
TP53 P04637 4/20 0.44
KDM4E B2RXH2 3/20 0.44
USP2 O75604 3/20 0.44
POLB P06746 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ALOX15 P16050 1/20 0.44
ALDH1A1 P00352 8/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
PKM P14618 1/20 0.43
HTT P42858 5/20 0.43
HPGD P15428 3/20 0.43
TSHR P16473 3/20 0.43

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
SCHEMBL2464487 0.87 MAOB (0.53) KMT2AMEN1MAPTNPSR1LMNA
SCHEMBL20112746 0.87 ELANE (0.40) KMT2AMEN1MAPTNPSR1LMNA
SCHEMBL31079953 0.83 KMT2A (0.42) KMT2AMEN1MAPTNPSR1LMNA
SCHEMBL18990273 0.83 KMT2A (0.42) KMT2AMEN1MAPTNPSR1LMNA
SCHEMBL13862092 0.83 MAOB (0.42) KMT2AMEN1MAPTNPSR1LMNA
SCHEMBL18522596 0.82 KMT2A (0.38) KMT2AMEN1MAPTNPSR1LMNA
SCHEMBL11145280 0.81 KMT2A (0.41) KMT2AMEN1MAPTNPSR1LMNA
SCHEMBL20112832 0.81 MAPT (0.42) KMT2AMEN1MAPTNPSR1LMNA
SCHEMBL18991212 0.79 KMT2A (0.39) KMT2AMEN1MAPTNPSR1LMNA
SCHEMBL4969703 0.79 MEN1 (0.42) KMT2AMEN1MAPTNPSR1LMNA

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
US-4366171-A Fungicidal biphenyl esters, mixtures thereof and method of use GAF CORPORATION (US) 1982-12-28 US disclosed