SCHEMBL7364392

SCHEMBL7364392

COC(=O)c1cccc(-c2nn(C(C)C)c(=O)c3ncccc23)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
TSHR P16473 2/20 0.51
POLB P06746 1/20 0.51
HSD17B10 Q99714 1/20 0.51
KDM5B Q9UGL1 1/20 0.47
KAT2B Q92831 1/20 0.46
ALDH1A1 P00352 3/20 0.43
HPGD P15428 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GRM5 P41594 2/20 0.42
TGFBR1 P36897 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NEK1 Q96PY6 3/20 0.41
PIK3CD O00329 1/20 0.41
ABL1 P00519 1/20 0.41
EGFR P00533 1/20 0.41
HCK P08631 1/20 0.41
SRC P12931 1/20 0.41
KDR P35968 1/20 0.41
PIK3CA P42336 1/20 0.41

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
SCHEMBL7371143 0.92 KDM4E (0.53) KDM4ETSHRPOLBHSD17B10KDM5B
SCHEMBL7367931 0.88 HPGD (0.55) KDM4ETSHRPOLBHSD17B10KDM5B
SCHEMBL7369732 0.84 KDM4E (0.44) KDM4ETSHRPOLBHSD17B10KAT2B
SCHEMBL8699836 0.83 TBXAS1 (0.45) KDM4ETSHRKDM5BKAT2BALDH1A1
SCHEMBL7366042 0.83 PIK3CD (0.50) KDM5BKAT2BPIK3CDABL1EGFR
SCHEMBL7370126 0.82 GRM5 (0.48) KDM5BALDH1A1HPGDL3MBTL1GRM5
SCHEMBL7364396 0.82 ALDH1A1 (0.52) TSHRPOLBKDM5BKAT2BALDH1A1
SCHEMBL7370208 0.80 PDE4A (0.53) HSD17B10KDM5BHPGDHTT
SCHEMBL7365433 0.80 ADORA1 (0.39) ALDH1A1L3MBTL1TGFBR1PIK3CDABL1
SCHEMBL7359391 0.80 MAPK10 (0.50) KDM4ETSHRALDH1A1HPGDGRM5

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-0612321-A1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1994-08-31 EP disclosed
WO-1993007146-A1 BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1993-04-15 WO disclosed