SCHEMBL7985256

SCHEMBL7985256

CC(C)(OC(N)=O)c1ccccc1.NC(=O)OCc1ccc(Cl)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.46
MEN1 O00255 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
PKM P14618 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GAA P10253 1/20 0.44
FABP3 P05413 1/20 0.43
FABP4 P15090 1/20 0.43
FABP5 Q01469 1/20 0.43
TP53 P04637 1/20 0.42
NR4A2 P43354 2/20 0.42
NR4A1 P22736 1/20 0.42
NR4A3 Q92570 1/20 0.42
MAPT P10636 2/20 0.41
IDO1 P14902 2/20 0.41
MRGPRX4 Q96LA9 1/20 0.41

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
SCHEMBL116267 0.82 IDO1 (0.59) L3MBTL1MEN1CYP1A2CYP2C19KMT2A
SCHEMBL7985257 0.78 TP53 (0.40) L3MBTL1MEN1KMT2AFABP3FABP4
SCHEMBL112703 0.76 MAPT (0.55) L3MBTL1CYP1A2CYP2C19KMT2ACYP2D6
SCHEMBL29223611 0.75 L3MBTL1 (0.52) L3MBTL1MEN1CYP1A2CYP2C19KMT2A
Propane SCHEMBL28558464 0.74 MAPT (0.50) L3MBTL1CYP1A2CYP2C19KMT2ACYP2D6
SCHEMBL30035044 0.74 ALDH1A1 (0.50) L3MBTL1CYP1A2CYP2C19KMT2ACYP2C9
SCHEMBL6666901 0.71 L3MBTL1 (0.74) L3MBTL1MEN1CYP1A2CYP2C19KMT2A
SCHEMBL6645333 0.71 MRGPRX4 (0.57) L3MBTL1MEN1CYP1A2CYP2C19KMT2A
SCHEMBL25400027 0.70 L3MBTL1 (0.44) L3MBTL1MEN1CYP1A2CYP2C19KMT2A
SCHEMBL11888397 0.70 GAA (0.64) L3MBTL1MEN1CYP1A2CYP2C19KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0732944-A4 LABELED CHEMOTACTIC PEPTIDES TO IMAGE FOCAL SITES OF INFECTION OR INFLAMMATION GEN HOSPITAL CORP (US) 2000-06-07 EP disclosed
EP-0732944-A1 LABELED CHEMOTACTIC PEPTIDES TO IMAGE FOCAL SITES OF INFECTION OR INFLAMMATION THE GENERAL HOSPITAL CORPORATION (US) 1996-09-25 EP disclosed
WO-1995011045-A1 LABELED CHEMOTACTIC PEPTIDES TO IMAGE FOCAL SITES OF INFECTION OR INFLAMMATION THE GENERAL HOSPITAL CORPORATION (US) 1995-04-27 WO disclosed