SCHEMBL23401461

SCHEMBL23401461

CCCc1cc(O)n(-c2ccccc2)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
ALDH1A1 P00352 2/20 0.57
CNR1 P21554 1/20 0.54
CNR2 P34972 1/20 0.54
USP2 O75604 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
HTT P42858 1/20 0.43
ALOX5 P09917 1/20 0.42
RXRA P19793 2/20 0.42
RXRB P28702 2/20 0.42
RXRG P48443 2/20 0.42
TSHR P16473 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 2/20 0.39
KDM4E B2RXH2 2/20 0.39
CTSK P43235 1/20 0.39
CYP1A2 P05177 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL23401774 0.90 CNR1 (0.62) LMNAALDH1A1CNR1CNR2USP2
SCHEMBL23398638 0.87 ALDH1A1 (0.45) LMNAALDH1A1CNR1CNR2USP2
SCHEMBL9966162 0.86 LMNA (0.45) LMNAALDH1A1CNR1CNR2USP2
SCHEMBL23400932 0.84 ALDH1A1 (0.45) LMNAALDH1A1CNR1CNR2USP2
SCHEMBL23402042 0.81 ALDH1A1 (0.43) LMNAALDH1A1CNR1CNR2HTT
SCHEMBL23400335 0.81 ALDH1A1 (0.40) LMNAALDH1A1CNR1CNR2USP2
SCHEMBL27795107 0.81 ALDH1A1 (0.59) LMNAALDH1A1CNR1CNR2L3MBTL1
SCHEMBL3619826 0.79 RXRA (0.45) LMNAALDH1A1HTTRXRARXRB
SCHEMBL23400074 0.78 CACNA1H (0.47) ALDH1A1CNR1CNR2GAA
SCHEMBL23401415 0.78 CNR1 (0.49) LMNAALDH1A1CNR1CNR2USP2

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