SCHEMBL23403115

SCHEMBL23403115

CCc1c(C)nn(C(C)C)c1O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
P2RX7 Q99572 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
SCHEMBL23402278 0.84 MAPT (0.32) ALDH1A1MAPTHTT
SCHEMBL23403173 0.82 FFAR1 (0.37) ALDH1A1MAPTHTT
SCHEMBL23402336 0.82 ALDH1A1 (0.33) ALDH1A1MAPTHTTP2RX7
SCHEMBL23402103 0.79 POLB (0.32)
SCHEMBL19184468 0.78 RET (0.34)
SCHEMBL23402331 0.78 GCGR (0.33)
SCHEMBL23402576 0.75 KDM4E (0.33)
SCHEMBL23401058 0.75 SMN1; SMN2 (0.40) ALDH1A1P2RX7
SCHEMBL12806621 0.74 KDM4E (0.33) ALDH1A1HTT
SCHEMBL23399659 0.73 ALDH1A1 (0.33) ALDH1A1MAPTHTT

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