SCHEMBL8623087

SCHEMBL8623087

O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(Sc2ccc(C(F)(F)F)cc2Cl)cc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MAPT P10636 2/20 0.46
USP2 O75604 1/20 0.46
ALOX15 P16050 1/20 0.46
IL2 P60568 3/20 0.45
ATM Q13315 1/20 0.43
TLR7 Q9NYK1 3/20 0.43
TRPV1 Q8NER1 1/20 0.42
GAA P10253 3/20 0.41
TLR8 Q9NR97 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
KDR P35968 1/20 0.38
HPGD P15428 1/20 0.38
CA12 O43570 1/20 0.37

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
SCHEMBL9743573 0.88 MEN1 (0.54) MEN1KMT2AMAPTUSP2ALOX15
SCHEMBL8621586 0.88 IL2 (0.54) MEN1KMT2AMAPTUSP2ALOX15
SCHEMBL8620837 0.87 PYGL (0.46) MEN1KMT2AMAPTTRPV1GAA
SCHEMBL9743731 0.85 MEN1 (0.48) MEN1KMT2AMAPTUSP2ALOX15
SCHEMBL9744019 0.85 MEN1 (0.47) MEN1KMT2AMAPTUSP2ALOX15
SCHEMBL9743838 0.85 MEN1 (0.47) MEN1KMT2AMAPTUSP2ALOX15
SCHEMBL6504707 0.84 MEN1 (0.47) MEN1KMT2AMAPTUSP2ALOX15
SCHEMBL352658 0.83 MEN1 (0.54) MEN1KMT2AMAPTUSP2ALOX15
SCHEMBL29608194 0.83 MEN1 (0.54) MEN1KMT2AMAPTUSP2ALOX15
SCHEMBL9743510 0.81 MEN1 (0.56) MEN1KMT2AMAPTUSP2ALOX15

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-5854288-A Use of benzoylureas for controlling house dust mites HOECHST SCHERING AGREVO GMBH (DE) 1998-12-29 US disclosed