SCHEMBL24671091

SCHEMBL24671091

CC(C)(C)OC(=O)N1CC=C(c2ccc(C(=O)Nc3ccc(C4=CCN(C(=O)OC(C)(C)C)CC4)c(Cl)c3)s2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.47
PDK4 Q16654 1/20 0.45
JAK1 P23458 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CNR1 P21554 2/20 0.42
DGAT2 Q96PD7 1/20 0.42
KIT P10721 1/20 0.41
SCN9A Q15858 1/20 0.41
TRPV1 Q8NER1 2/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
HTR6 P50406 1/20 0.40
PDE10A Q9Y233 1/20 0.40
F13A1 P00488 1/20 0.40
TGM2 P21980 1/20 0.40
TGM1 P22735 1/20 0.40
TGM3 Q08188 1/20 0.40

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
SCHEMBL29803594 1.00 NAMPT (0.47) NAMPTPDK4JAK1MEN1KMT2A
SCHEMBL24669259 0.89 NAMPT (0.47) NAMPTPDK4JAK1KITSCN9A
SCHEMBL29803799 0.89 NAMPT (0.47) NAMPTPDK4JAK1KITSCN9A
SCHEMBL29803262 0.89 NAMPT (0.46) NAMPTPDK4JAK1CNR1KIT
SCHEMBL24670587 0.89 NAMPT (0.46) NAMPTPDK4JAK1CNR1KIT
SCHEMBL24671142 0.86 NAMPT (0.52) NAMPTPDK4JAK1MEN1KMT2A
SCHEMBL29803371 0.86 NAMPT (0.52) NAMPTPDK4JAK1MEN1KMT2A
SCHEMBL24669280 0.86 NAMPT (0.62) NAMPTPDK4JAK1KITLMNA
SCHEMBL29803333 0.85 TRPV1 (0.37) NAMPTPDK4JAK1MEN1KMT2A
SCHEMBL29803234 0.84 MAPT (0.44) MEN1KMT2ATRPV1LMNAMAPT

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