SCHEMBL24671538

SCHEMBL24671538

CCOc1cc(NC(=O)c2ccc(Br)c(F)c2)ccc1Br

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.58
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
KCNQ3 O43525 1/20 0.57
KCNQ2 O43526 1/20 0.57
SMN1; SMN2 Q16637 7/20 0.55
TP53 P04637 4/20 0.55
MAOB P27338 1/20 0.52
KDM4E B2RXH2 2/20 0.52
HTT P42858 1/20 0.52
NPC1 O15118 3/20 0.51
MAPK1 P28482 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
HSD17B10 Q99714 2/20 0.50
ALOX15 P16050 1/20 0.50
ALOX12 P18054 1/20 0.50
NR4A1 P22736 1/20 0.50
LMNA P02545 4/20 0.48
GAA P10253 3/20 0.48
ALDH1A1 P00352 2/20 0.48

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
SCHEMBL24669380 0.86 GRM4 (0.56) MAPTMEN1KMT2AKCNQ3KCNQ2
SCHEMBL29803730 0.86 GRM4 (0.56) MAPTMEN1KMT2AKCNQ3KCNQ2
SCHEMBL2683383 0.84 MAPT (0.52) MAPTMEN1KMT2AKCNQ3KCNQ2
SCHEMBL29803408 0.82 MAOB (0.70) MAPTMEN1KMT2AKCNQ3KCNQ2
SCHEMBL24669338 0.82 MAOB (0.70) MAPTMEN1KMT2AKCNQ3KCNQ2
SCHEMBL24670229 0.82 MAOB (0.56) MAPTMEN1KMT2AKCNQ3KCNQ2
SCHEMBL24670881 0.81 MAOB (0.53) MAPTMEN1KMT2ASMN1; SMN2MAOB
SCHEMBL24670265 0.80 GRM4 (0.55) MAPTMEN1KMT2AKCNQ3KCNQ2
SCHEMBL24670851 0.79 MAOB (0.59) MAPTMEN1KMT2AKCNQ3KCNQ2
SCHEMBL29803287 0.79 MAOB (0.59) MAPTMEN1KMT2AKCNQ3KCNQ2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 WO disclosed
WO-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 WO disclosed