SCHEMBL11229152

SCHEMBL11229152

O=C(CCCl)Oc1ccc(-c2ccc(OC(=O)CCCl)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.53
LMNA P02545 3/20 0.53
HSD17B10 Q99714 2/20 0.53
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
HTT P42858 1/20 0.53
BCL9 O00512 1/20 0.42
CTNNB1 P35222 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.40
MEN1 O00255 2/20 0.40
ESR1 P03372 2/20 0.40
HIF1A Q16665 2/20 0.40
RECQL P46063 1/20 0.40
ASAH1 Q13510 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RAB9A P51151 2/20 0.38
KIF11 P52732 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38

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
SCHEMBL4641736 0.86 KMT2A (0.52) KMT2ALMNAHSD17B10ALDH1A1MAPT
SCHEMBL4642418 0.84 KMT2A (0.60) KMT2ALMNAHSD17B10ALDH1A1MAPT
SCHEMBL6740542 0.84 KMT2A (0.58) KMT2ALMNAHSD17B10ALDH1A1MAPT
SCHEMBL4642464 0.84 KMT2A (0.50) KMT2ALMNAHSD17B10ALDH1A1MAPT
SCHEMBL5765022 0.84 SMN1; SMN2 (0.53) KMT2ALMNAHSD17B10ALDH1A1MAPT
SCHEMBL1918494 0.83 PRSS1 (0.50) KMT2ALMNAHSD17B10ALDH1A1MAPT
SCHEMBL16671296 0.82 HSD17B10 (0.49) KMT2ALMNAHSD17B10ALDH1A1MAPT
SCHEMBL11260215 0.81 KMT2A (0.52) KMT2ALMNAHSD17B10ALDH1A1MAPT
SCHEMBL4643454 0.81 KMT2A (0.55) KMT2ALMNAHSD17B10ALDH1A1MAPT
SCHEMBL4647016 0.81 KMT2A (0.74) KMT2ALMNAHSD17B10ALDH1A1MAPT

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