SCHEMBL24669366

SCHEMBL24669366

O=C(Nc1ccc(Br)c(F)c1)c1ccc(Br)cc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.51
LMNA P02545 4/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 2/20 0.51
ALDH1A1 P00352 2/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 5/20 0.50
MEN1 O00255 4/20 0.50
NPSR1 Q6W5P4 2/20 0.50
TMPRSS4 Q9NRS4 2/20 0.50
XBP1 P17861 1/20 0.50
HTT P42858 4/20 0.48
PTPRC P08575 1/20 0.46
MAOB P27338 1/20 0.45
POLB P06746 1/20 0.44
PTGS1 P23219 2/20 0.43
KCNK3 O14649 1/20 0.43
KCNK9 Q9NPC2 1/20 0.43
GPR27 Q9NS67 1/20 0.43

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
SCHEMBL29803460 1.00 KMT2A (0.51) KMT2ALMNARAB9ASMN1; SMN2NPC1
SCHEMBL24669370 0.86 LMNA (0.55) KMT2ALMNARAB9ASMN1; SMN2NPC1
SCHEMBL29803423 0.86 LMNA (0.55) KMT2ALMNARAB9ASMN1; SMN2NPC1
SCHEMBL24670924 0.85 RAB9A (0.69) KMT2ALMNARAB9ASMN1; SMN2NPC1
SCHEMBL24669477 0.81 RAB9A (0.53) KMT2ALMNARAB9ASMN1; SMN2NPC1
SCHEMBL29803393 0.80 MAPT (0.72) KMT2ALMNARAB9ASMN1; SMN2NPC1
SCHEMBL24671304 0.80 MAPT (0.72) KMT2ALMNARAB9ASMN1; SMN2NPC1
SCHEMBL24670991 0.79 RAB9A (0.56) KMT2ALMNARAB9ASMN1; SMN2NPC1
SCHEMBL24460162 0.78 TMPRSS4 (0.64) KMT2ALMNARAB9ASMN1; SMN2NPC1
SCHEMBL24670710 0.76 MAPT (0.75) KMT2ALMNARAB9ASMN1; SMN2NPC1

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
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