SCHEMBL7795629

SCHEMBL7795629

CCC(OC(C)=O)OC(=O)C1CCOCC1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
PIK3CD O00329 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL7793643 0.78 ALDH1A1 (0.33) ALDH1A1LMNAPIK3CD
SCHEMBL7606612 0.78 PIK3CD (0.37) PIK3CD
SCHEMBL7601634 0.78 PIK3CD (0.37) PIK3CD
SCHEMBL5987773 0.78 PIK3CD (0.37) PIK3CD
SCHEMBL31112516 0.77 PIK3CD (0.33) ALDH1A1PIK3CDSMN1; SMN2
SCHEMBL315270 0.74 TSHR (0.48) ALDH1A1LMNASMN1; SMN2
SCHEMBL5361281 0.73 PIK3CD (0.39) ALDH1A1PIK3CDSMN1; SMN2
SCHEMBL18074616 0.73 ALDH1A1 (0.32) ALDH1A1LMNA
SCHEMBL16809083 0.72 GAA (0.33) ALDH1A1SMN1; SMN2
SCHEMBL14753062 0.70 PIK3CD (0.41) PIK3CDSMN1; 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-2010150840-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE 大日本住友製薬株式会社 (JP) 2010-12-29 WO disclosed