SCHEMBL23401686

SCHEMBL23401686

CCCCc1c(O)nn(-c2ccccc2C)c1CC

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 3/20 0.39
APLNR P35414 2/20 0.35
ALDH1A1 P00352 5/20 0.35
HSP90AA1 P07900 1/20 0.35
HSD11B1 P28845 1/20 0.34
THRB P10828 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL23400896 0.93 ALDH1A1 (0.36) POLBL3MBTL1MAPTAPLNRALDH1A1
SCHEMBL23401494 0.93 POLB (0.40) POLBL3MBTL1MAPTAPLNRALDH1A1
SCHEMBL23401781 0.92 POLB (0.39) POLBL3MBTL1MAPTAPLNRALDH1A1
SCHEMBL23399672 0.90 POLB (0.39) POLBL3MBTL1MAPTAPLNRALDH1A1
SCHEMBL23403680 0.90 POLB (0.39) POLBL3MBTL1MAPTAPLNRALDH1A1
SCHEMBL23402285 0.88 ALDH1A1 (0.38) L3MBTL1MAPTALDH1A1HSD11B1THRB
SCHEMBL23401793 0.87 L3MBTL1 (0.37) POLBL3MBTL1MAPTAPLNRALDH1A1
SCHEMBL23400121 0.86 MAPT (0.37) POLBL3MBTL1MAPTAPLNRALDH1A1
SCHEMBL23401041 0.86 POLB (0.40) POLBL3MBTL1MAPTAPLNRALDH1A1
SCHEMBL23401253 0.84 MAPT (0.36) POLBL3MBTL1MAPTAPLNRALDH1A1

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