SCHEMBL7364396

SCHEMBL7364396

CCCn1nc(-c2cccc(C(=O)OC)c2)c2cccnc2c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
TSHR P16473 4/20 0.52
NPSR1 Q6W5P4 2/20 0.52
LMNA P02545 1/20 0.52
HPGD P15428 2/20 0.43
TGFBR1 P36897 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KAT2B Q92831 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM5B Q9UGL1 1/20 0.41
PMM2 O15305 1/20 0.41
MPI P34949 1/20 0.41
RAB9A P51151 1/20 0.41
PHOSPHO1 Q8TCT1 1/20 0.41
GRM5 P41594 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
MAPK10 P53779 1/20 0.40
PDE4A P27815 2/20 0.40

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
SCHEMBL8699836 0.92 TBXAS1 (0.45) ALDH1A1TSHRNPSR1LMNAHPGD
SCHEMBL7367933 0.89 ALDH1A1 (0.56) ALDH1A1TSHRNPSR1LMNAHPGD
SCHEMBL7359391 0.86 MAPK10 (0.50) ALDH1A1TSHRNPSR1LMNAHPGD
SCHEMBL7372566 0.85 PDE4A (0.58) ALDH1A1TSHRHPGDL3MBTL1KDM5B
SCHEMBL7369736 0.84 TSHR (0.45) ALDH1A1TSHRNPSR1LMNAHPGD
SCHEMBL7362649 0.84 PDE4A (0.50) ALDH1A1TSHRNPSR1LMNAHPGD
SCHEMBL7366044 0.83 TP53 (0.45) ALDH1A1LMNAHPGDKAT2BKMT2A
SCHEMBL7364392 0.82 KDM4E (0.51) ALDH1A1TSHRNPSR1HPGDTGFBR1
SCHEMBL7365437 0.81 PDE4A (0.43) ALDH1A1TGFBR1RAB9AMEN1KMT2A
SCHEMBL7370212 0.81 PDE4A (0.59) ALDH1A1NPSR1L3MBTL1MEN1KMT2A

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