SCHEMBL30956375

SCHEMBL30956375

C[C@]12C(=O)CCC[C@H]1CCCC2=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
MAPT P10636 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP19A1 P11511 1/20 0.35
TP53 P04637 3/20 0.32
CYP3A4 P08684 3/20 0.32
MAPK1 P28482 3/20 0.32
HIF1A Q16665 2/20 0.32
CYP1A2 P05177 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
TSHR P16473 2/20 0.32
NFKB1 P19838 1/20 0.32
THPO P40225 1/20 0.32
PPM1B O75688 1/20 0.32
PTPN1 P18031 1/20 0.32
PPP1CC P36873 1/20 0.32

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
SCHEMBL19628669 0.72 APP (0.37) LMNAKMT2AMEN1MAPTALDH1A1
SCHEMBL6751474 0.72 HDAC6 (0.32)
SCHEMBL20969383 0.72 CYP19A1 (0.37) CYP19A1
SCHEMBL17554566 0.70 TP53 (0.38) LMNAKMT2AMEN1MAPTTP53
SCHEMBL11800559 0.70 CYP19A1 (0.46) LMNAKMT2AMEN1MAPTALDH1A1
SCHEMBL24483410 0.69 CYP19A1 (0.48) LMNAKMT2AMEN1MAPTALDH1A1
SCHEMBL2575741 0.69 CYP19A1 (0.48) LMNAKMT2AMEN1MAPTALDH1A1
SCHEMBL9419571 0.68 CA1 (0.34) LMNAKMT2AMEN1MAPTALDH1A1
SCHEMBL21575977 0.68 CA1 (0.34) LMNAKMT2AMEN1MAPTALDH1A1
SCHEMBL183432 0.68 CA1 (0.34) LMNAKMT2AMEN1MAPTALDH1A1

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
CN-118222446-A Application of coltsfoot bacillus in Kangpu tea and zymophyte 贵州大学 2024-06-21 CN disclosed