SCHEMBL11520271

SCHEMBL11520271

O=C(CC(C(=O)c1ccccc1)c1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.60
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
PDPK1 O15530 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
NTSR1 P30989 1/20 0.56
L3MBTL1 Q9Y468 4/20 0.55
MAPT P10636 2/20 0.55
LMNA P02545 2/20 0.55
KDM4E B2RXH2 1/20 0.55
ALDH1A1 P00352 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
MGAM O43451 1/20 0.50
GAA P10253 1/20 0.50
SI P14410 1/20 0.50
MGAM2 Q2M2H8 1/20 0.50
HSD17B10 Q99714 1/20 0.49
CES2 O00748 1/20 0.49

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
SCHEMBL11733805 1.00 POLB (0.60) POLBKMT2AMEN1PDPK1CYP2C9
SCHEMBL29110188 0.95 POLB (0.61) POLBKMT2AMEN1PDPK1CYP2C9
SCHEMBL6201780 0.90 LMNA (0.65) KMT2AMEN1PDPK1CYP2C9CYP2C19
SCHEMBL8529364 0.90 POLB (0.53) POLBKMT2AMEN1PDPK1CYP2C9
SCHEMBL30466138 0.87 NTSR1 (0.58) POLBKMT2AMEN1PDPK1CYP2C9
SCHEMBL29110275 0.85 KMT2A (0.81) POLBKMT2AMEN1PDPK1L3MBTL1
SCHEMBL30121900 0.85 KMT2A (0.81) POLBKMT2AMEN1PDPK1L3MBTL1
SCHEMBL11521612 0.84 POLB (0.58) POLBKMT2AMEN1L3MBTL1MAPT
SCHEMBL11526582 0.84 ALDH1A1 (0.55) KMT2AMEN1PDPK1CYP2C9CYP2C19
SCHEMBL11733684 0.84 NTSR1 (0.56) POLBKMT2APDPK1CYP2C9CYP2C19

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-4174405-A MITICIDES UNIROYAL, INC. (US) 1979-11-13 US disclosed