SCHEMBL24671032

SCHEMBL24671032

CC(C)(C)OC(=O)N1CCN(c2ccc(NC(=O)c3ccc(Br)c(F)c3)nc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 4/20 0.52
SMN1; SMN2 Q16637 5/20 0.48
MAPT P10636 4/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
TSHR P16473 1/20 0.48
F13A1 P00488 1/20 0.46
TGM2 P21980 1/20 0.46
TGM1 P22735 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LMNA P02545 3/20 0.45
ALDH1A1 P00352 2/20 0.44
NPC1 O15118 1/20 0.44
CYP2C19 P33261 1/20 0.44
NAMPT P43490 1/20 0.43
GPR119 Q8TDV5 1/20 0.43
ALK Q9UM73 1/20 0.43
PDK2 Q15119 1/20 0.42

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
SCHEMBL24671578 0.83 WNT3A (0.47) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL24671474 0.81 WNT3A (0.45) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL30385866 0.80 WNT3A (0.56) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL29373833 0.80 MAPT (0.55) SMN1; SMN2MAPTMEN1KMT2ATSHR
SCHEMBL2386743 0.80 MAPT (0.55) SMN1; SMN2MAPTMEN1KMT2ATSHR
SCHEMBL24670245 0.79 LMNA (0.50) SMN1; SMN2MAPTMEN1KMT2ATSHR
SCHEMBL29803679 0.79 LMNA (0.50) SMN1; SMN2MAPTMEN1KMT2ATSHR
SCHEMBL28907538 0.79 WNT3A (0.63) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL24669307 0.78 LMNA (0.51) SMN1; SMN2MAPTMEN1KMT2ATSHR
SCHEMBL24670621 0.78 CHRM1 (0.57) SMN1; SMN2MAPTMEN1KMT2AHTT

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