SCHEMBL24865322

SCHEMBL24865322

CCC(=O)N(c1ccccc1)C(C)(C)[C@@H](C)CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.41
ALDH1A1 P00352 3/20 0.41
TP53 P04637 2/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
GLA P06280 1/20 0.39
TSHR P16473 1/20 0.39
OPRM1 P35372 5/20 0.37
SIGMAR1 Q99720 1/20 0.37
KIF11 P52732 1/20 0.37
APAF1 O14727 1/20 0.37
NPC1 O15118 1/20 0.37
CASP3 P42574 1/20 0.37
HTT P42858 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37

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
SCHEMBL25542682 0.77 KMT2A (0.43) SMN1; SMN2ALDH1A1TP53LMNAMEN1
SCHEMBL1232993 0.77 KMT2A (0.43) SMN1; SMN2ALDH1A1TP53LMNAMEN1
SCHEMBL5068716 0.75 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1TP53LMNAMEN1
SCHEMBL4289552 0.75 MAPT (0.41) SMN1; SMN2ALDH1A1TP53LMNAMEN1
SCHEMBL4300960 0.74 ROCK2 (0.35) SMN1; SMN2ALDH1A1TP53LMNAMEN1
Hydrochloric Acid SCHEMBL6557848 0.73 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1TP53LMNAMEN1
SCHEMBL25571365 0.72 OPRM1 (0.39) SMN1; SMN2ALDH1A1TP53MEN1CYP3A4
SCHEMBL26029270 0.70 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1TP53LMNAKMT2A
SCHEMBL12821356 0.69 ALDH1A1 (0.71) SMN1; SMN2ALDH1A1TP53LMNAMEN1
SCHEMBL22406302 0.68 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1TP53LMNAKMT2A

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-2023282236-A1 RARE EARTH COMPLEX 東ソー株式会社 2023-01-12 WO disclosed