SCHEMBL28094541

SCHEMBL28094541

C=C=CC(C)C(=O)CC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.32
SRR Q9GZT4 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
SCHEMBL28799533 0.82 ALOX15 (0.32) LDHASRR
SCHEMBL29127640 0.77
SCHEMBL28242738 0.75
SCHEMBL9130419 0.71 LDHA (0.36) LDHASRR
SCHEMBL28249165 0.70
SCHEMBL27870398 0.67 GABRP (0.45)
SCHEMBL27454017 0.67 FFAR1 (0.33)
SCHEMBL517270 0.66
SCHEMBL5316721 0.65 KDM7A (0.32) LDHASRR
SCHEMBL165376 0.64

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-102766190-B Triptolide alcohol intermediate method of asymmetric synthesis 兰州大学 2016-08-17 CN disclosed