SCHEMBL23402960

SCHEMBL23402960

CCc1c(C(C)C)[nH]n(C(C)(C)C)c1=O

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ GAA P10253 2/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL23401979 0.86 LMNA (0.30) LMNAMAPTHTTSMN1; SMN2
SCHEMBL23403573 0.84 LMNA (0.31) LMNAMAPTHTTSMN1; SMN2
SCHEMBL23401753 0.83 TYMP (0.32) LMNAGAAALDH1A1CYP2C9CYP2C19
SCHEMBL23399279 0.76 LMNA (0.30) LMNAMAPTHTTSMN1; SMN2
SCHEMBL23399873 0.76 MEN1 (0.31) ALDH1A1MEN1KMT2A
SCHEMBL23401440 0.76 GAA (0.39) LMNAMAPTHTTSMN1; SMN2GAA
SCHEMBL23401614 0.76 KDM4E (0.30) ALDH1A1
SCHEMBL23402202 0.76 ALDH1A1 (0.42) LMNAMAPTHTTSMN1; SMN2GAA
SCHEMBL23401467 0.76 GAA (0.33) LMNAMAPTHTTSMN1; SMN2GAA
SCHEMBL23402606 0.74 LMNA (0.33) LMNAMAPTHTTSMN1; SMN2GAA

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-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 — — EP disclosed
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