SCHEMBL25699072

SCHEMBL25699072

CCON1C(C)(C)CC(OC(=O)CCCC(=O)OC2CC(C)(C)N(OCC)C(C)(C)C2)CC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
NAAA Q02083 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.37
TSHR P16473 3/20 0.36
ALDH1A1 P00352 1/20 0.35
ESR1 P03372 1/20 0.35
HSD17B10 Q99714 1/20 0.35
EPHX2 P34913 4/20 0.32
SMYD3 Q9H7B4 1/20 0.32
TP53 P04637 1/20 0.31

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
SCHEMBL7479511 0.95 NAAA (0.46) KMT2AMEN1GAANAAASMN1; SMN2
SCHEMBL27962250 0.94 TSHR (0.38) KMT2AMEN1GAANAAASMN1; SMN2
SCHEMBL28323570 0.88 TSHR (0.37) KMT2AMEN1GAANAAATSHR
SCHEMBL15298646 0.85 KMT2A (0.34) KMT2AMEN1GAANAAATSHR
SCHEMBL23593774 0.85 NAAA (0.43) KMT2AMEN1GAANAAAEPHX2
SCHEMBL9737876 0.85 NAAA (0.45) KMT2AMEN1GAANAAASMN1; SMN2
SCHEMBL13763618 0.84 NAAA (0.49) KMT2AMEN1GAANAAAEPHX2
SCHEMBL15389424 0.84 NAAA (0.48) KMT2AMEN1GAANAAASMN1; SMN2
SCHEMBL13130571 0.83 TSHR (0.39) KMT2AMEN1GAATSHRALDH1A1
SCHEMBL39302 0.82 KMT2A (0.38) KMT2AMEN1GAANAAASMN1; SMN2

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-2023109506-A1 POLYMERIC STERICALLY HINDERED AMINE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 天集化工助剂(沧州)有限公司 2023-06-22 WO disclosed