SCHEMBL23399543

SCHEMBL23399543

Cc1ccc(-n2cc(O)c(-c3cccc(C)c3)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
ALDH1A1 P00352 5/20 0.50
NPSR1 Q6W5P4 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 4/20 0.49
MAPT P10636 4/20 0.49
KDM4E B2RXH2 3/20 0.49
TDP1 Q9NUW8 2/20 0.49
GAA P10253 2/20 0.48
MITF O75030 1/20 0.47
LMNA P02545 3/20 0.46
CNR1 P21554 2/20 0.46
GPR55 Q9Y2T6 2/20 0.46
CNR2 P34972 1/20 0.46
HTT P42858 1/20 0.46
HPGD P15428 1/20 0.46
PPARG P37231 1/20 0.46
NCOA2 Q15596 1/20 0.46

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
SCHEMBL23400218 0.91 ALDH1A1 (0.54) MEN1KMT2AALDH1A1NPSR1L3MBTL1
SCHEMBL23400477 0.90 ALDH1A1 (0.46) MEN1KMT2AALDH1A1NPSR1L3MBTL1
SCHEMBL23400907 0.88 LMNA (0.49) MEN1KMT2AALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL23399568 0.86 KMT2A (0.58) MEN1KMT2AALDH1A1NPSR1SMN1; SMN2
SCHEMBL23401203 0.85 KMT2A (0.51) MEN1KMT2AALDH1A1NPSR1SMN1; SMN2
SCHEMBL23402521 0.84 KMT2A (0.55) MEN1KMT2AALDH1A1NPSR1SMN1; SMN2
SCHEMBL23402636 0.82 ALDH1A1 (0.54) MEN1KMT2AALDH1A1NPSR1L3MBTL1
SCHEMBL23399040 0.80 KMT2A (0.67) MEN1KMT2AALDH1A1NPSR1SMN1; SMN2
SCHEMBL23400999 0.80 CNR2 (0.39) MEN1KMT2AALDH1A1NPSR1L3MBTL1
SCHEMBL23399108 0.78 IDO1 (0.45) ALDH1A1L3MBTL1SMN1; SMN2POLBKDM4E

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