SCHEMBL31155751

SCHEMBL31155751

CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(N(C)C)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.69
KMT2A Q03164 1/20 0.69
KCNK3 O14649 2/20 0.55
SOAT2 O75908 1/20 0.53
ACAT1 P24752 1/20 0.53
SOAT1 P35610 1/20 0.53
ALDH1A1 P00352 4/20 0.52
MAPT P10636 3/20 0.52
KDM4E B2RXH2 1/20 0.52
TP53 P04637 1/20 0.52
MCL1 Q07820 1/20 0.52
HSD17B10 Q99714 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.49
HDAC1 Q13547 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
RAB9A P51151 2/20 0.47
HSP90AB1 P08238 1/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
POLB P06746 1/20 0.46

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
SCHEMBL8460947 0.83 LMNA (0.81) LMNAKMT2ASOAT2SOAT1SMN1; SMN2
SCHEMBL4315481 0.82 LMNA (1.00) LMNAKMT2AKCNK3SOAT2SOAT1
SCHEMBL19138403 0.81 KMT2A (0.73) LMNAKMT2AALDH1A1TP53SMN1; SMN2
Iodide SCHEMBL30758614 0.81 LMNA (0.97) LMNAKMT2AKCNK3SOAT2SOAT1
Hydrochloric Acid SCHEMBL28857355 0.81 LMNA (0.97) LMNAKMT2AKCNK3SOAT2SOAT1
SCHEMBL14788839 0.80 LMNA (0.71) LMNAKMT2AKCNK3ALDH1A1SMN1; SMN2
SCHEMBL9522516 0.80 KCNK3 (0.59) LMNAKCNK3ALDH1A1MAPTKDM4E
SCHEMBL24574896 0.79 LMNA (0.69) LMNAKMT2AMAPTTP53SMN1; SMN2
SCHEMBL16591365 0.79 LMNA (0.74) LMNAKMT2ASOAT2SOAT1SMN1; SMN2
SCHEMBL14777468 0.77 KMT2A (0.66) LMNAKMT2AALDH1A1MAPTKDM4E

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
EP-4461724-A1 METHOD FOR PRODUCING AMIDE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-11-13 EP disclosed