SCHEMBL11236591

SCHEMBL11236591

N#Cc1ccc(COc2c(Cl)cc(NC(=O)NC(=O)c3c(F)cccc3F)cc2Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SMPD1 P17405 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
PYGL P06737 1/20 0.41
USP2 O75604 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
LRRK2 Q5S007 2/20 0.39
SAE1 Q9UBE0 1/20 0.39
UBA2 Q9UBT2 1/20 0.39
CYP19A1 P11511 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MRGPRX4 Q96LA9 2/20 0.38
ITGB1 P05556 1/20 0.38
ITGA4 P13612 1/20 0.38
PPIA P62937 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
SCHEMBL8655810 0.89 MEN1 (0.48) MEN1KMT2ASMPD1PYGLUSP2
SCHEMBL11246608 0.89 MRGPRX4 (0.47) MEN1KMT2ASMPD1TAS1R3TAS1R1
SCHEMBL11229534 0.88 PYGL (0.49) MEN1KMT2APYGLUSP2MAPT
SCHEMBL11238812 0.85 SMPD1 (0.50) MEN1KMT2ASMPD1TAS1R3TAS1R1
SCHEMBL11240584 0.84 PYGL (0.58) SMPD1TAS1R3TAS1R1TAS1R2PYGL
SCHEMBL11244545 0.83 MAPT (0.49) MEN1KMT2APYGLMAPTPPIA
SCHEMBL17036167 0.81 MEN1 (0.53) MEN1KMT2APYGLUSP2MAPT
SCHEMBL10639537 0.81 NPC1 (0.45) MEN1KMT2ATAS1R3TAS1R1TAS1R2
SCHEMBL10639071 0.79 MEN1 (0.43) MEN1KMT2APYGLUSP2MAPT
SCHEMBL11242520 0.79 PTGER1 (0.45) MEN1KMT2AUSP2MAPTALOX15

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-4350706-A MITICIDES, LARVICIDES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1982-09-21 US disclosed