SCHEMBL9212237

SCHEMBL9212237

CCOc1ccc(CN2C(=O)C(Cc3ccc(O)cc3)NC2=NN=C(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 4/20 0.37
POLB P06746 2/20 0.37
HTT P42858 2/20 0.37
LTA4H P09960 1/20 0.36
CAPN1 P07384 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
THRB P10828 1/20 0.35
PIM1 P11309 1/20 0.35
PIM2 Q9P1W9 1/20 0.35

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
SCHEMBL9212219 1.00 GPR84 (0.39) GPR84MEN1KMT2AALDH1A1KDM4E
SCHEMBL7496845 0.90 MMP1 (0.43) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL7496842 0.90 MMP1 (0.43) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL7495637 0.86 GAA (0.52) KMT2AALDH1A1GAAPOLBHTT
SCHEMBL7495641 0.86 GAA (0.52) KMT2AALDH1A1GAAPOLBHTT
SCHEMBL13879515 0.68 HDAC1 (0.69) MEN1KMT2AALDH1A1GAAPOLB
SCHEMBL7492804 0.66 CAPN1 (0.40) MEN1KMT2AMAPTGAACAPN1
SCHEMBL7492801 0.66 CAPN1 (0.40) MEN1KMT2AMAPTGAACAPN1
SCHEMBL8291943 0.65 GAA (0.84) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL873923 0.65 HDAC6 (0.62) MEN1KMT2AMAPTGAAPOLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0638075-A1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-02-15 EP disclosed
WO-1994019335-A1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO disclosed