SCHEMBL23399668

SCHEMBL23399668

CCCc1c(O)nn(-c2ccccc2C)c1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
HSD11B1 P28845 1/20 0.33
GCGR P47871 1/20 0.33
DHODH Q02127 1/20 0.33
MAPT P10636 3/20 0.33
THRB P10828 1/20 0.33
MAPK1 P28482 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
APLNR P35414 1/20 0.33
KMT2A Q03164 2/20 0.33
USP2 O75604 1/20 0.33
HTT P42858 1/20 0.33
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.32
MEN1 O00255 1/20 0.32
PKM P14618 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HIF1A Q16665 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
SCHEMBL23402130 0.93 L3MBTL1 (0.38) ALDH1A1L3MBTL1HSD11B1GCGRDHODH
SCHEMBL23402046 0.89 ALDH1A1 (0.37) ALDH1A1L3MBTL1HSD11B1DHODHMAPT
SCHEMBL23402749 0.85 ALDH1A1 (0.39) ALDH1A1L3MBTL1HSD11B1DHODHMAPT
SCHEMBL23398400 0.83 PDE4A (0.39) ALDH1A1L3MBTL1HSD11B1MAPTTHRB
SCHEMBL23401155 0.82 USP2 (0.43) ALDH1A1GCGRMAPTMAPK1KMT2A
SCHEMBL23400121 0.82 MAPT (0.37) ALDH1A1L3MBTL1HSD11B1MAPTTHRB
SCHEMBL23399742 0.82 ALDH1A1 (0.37) ALDH1A1L3MBTL1HSD11B1MAPTTHRB
SCHEMBL23401601 0.81 ALDH1A1 (0.36) ALDH1A1L3MBTL1HSD11B1DHODHMAPT
SCHEMBL23400896 0.81 ALDH1A1 (0.36) ALDH1A1L3MBTL1HSD11B1MAPTTHRB
SCHEMBL23398978 0.80 ALDH1A1 (0.39) ALDH1A1L3MBTL1MAPTMAPK1HSP90AA1

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