SCHEMBL14039317

SCHEMBL14039317

C=C1CCC(=O)N1OC(=O)c1cc2cc(Cl)c(OC(C)=O)cc2oc1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.45
▸ KDM4E B2RXH2 4/20 0.45
▸ GLA P06280 4/20 0.45
▸ GAA P10253 4/20 0.45
▸ MEN1 O00255 4/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ MAPT P10636 2/20 0.45
▸ CASP1 P29466 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ CASP7 P55210 1/20 0.45
▸ GFER P55789 1/20 0.40
▸ F2 P00734 1/20 0.39
▸ CA12 O43570 3/20 0.36
▸ CA9 Q16790 3/20 0.36
▸ MAOB P27338 3/20 0.36
▸ GAPDH P04406 1/20 0.35
▸ HPGD P15428 2/20 0.34
▸ MAOA P21397 1/20 0.33
▸ POLB P06746 1/20 0.33

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
SCHEMBL12038288 0.93 KDM4E (0.49) KMT2AKDM4EGLAGAAMEN1
SCHEMBL12038303 0.82 MAOB (0.40) KMT2AKDM4EGLAGAAMEN1
SCHEMBL12038321 0.80 GAPDH (0.39) KMT2AKDM4EGLAGAAMEN1
SCHEMBL13494166 0.78 GPR35 (0.41) KMT2AKDM4EMEN1ALDH1A1HSD17B10
SCHEMBL17942948 0.75 RAB9A (0.50) KMT2AKDM4EGLAGAAMEN1
SCHEMBL12038319 0.72 KDM4E (0.54) KMT2AKDM4EGLAGAAMEN1
SCHEMBL12038323 0.71 MAOB (0.38) KMT2AKDM4EGLAGAAMEN1
SCHEMBL12038427 0.71 KDM4E (0.39) KMT2AKDM4EGLAGAAMEN1
SCHEMBL17942933 0.70 KDM4E (0.62) KMT2AKDM4EGLAGAAMEN1
SCHEMBL12038347 0.69 GLA (0.38) KMT2AKDM4EGLAGAAMEN1

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-8318953-B2 Reactive coumarin derivatives and their use in cellular analyses AAT BIOQUEST, INC. (US) 2012-11-27 — — US disclosed
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