SCHEMBL23966856

SCHEMBL23966856

COC(=O)/C=C1\OC(=O)C2CC=CC=C12

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL527137 0.69
SCHEMBL23914731 0.59 ALDH1A1 (0.55) MEN1ALDH1A1LMNAMAPTHPGD
SCHEMBL4764335 0.58 DYRK1A (0.44) ALDH1A1LMNAMAPTHPGDKMT2A
SCHEMBL11967669 0.57 PRKCA (0.30)
SCHEMBL2992690 0.57 PRKCA (0.30)
SCHEMBL1252076 0.57 ALDH1A1 (0.46) MEN1ALDH1A1LMNAMAPTHPGD
SCHEMBL1252074 0.57 ALDH1A1 (0.46) MEN1ALDH1A1LMNAMAPTHPGD
SCHEMBL9173461 0.56
SCHEMBL16976452 0.56 MAPT (0.44) MEN1ALDH1A1LMNAMAPTHPGD
SCHEMBL17993974 0.56

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-3649119-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GALAPAGOS NV (BE) 2021-11-03 EP disclosed