SCHEMBL7360220

SCHEMBL7360220

O=C(O)c1ccc(-c2nnc(=O)c3ccc[nH]c2-3)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 2/20 0.40
KDM4E B2RXH2 5/20 0.40
ALDH1A1 P00352 4/20 0.40
HPGD P15428 4/20 0.39
GLA P06280 3/20 0.39
GAA P10253 3/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MEN1 O00255 2/20 0.38
GPR84 Q9NQS5 2/20 0.37
KAT8 Q9H7Z6 1/20 0.37
CAMKK2 Q96RR4 1/20 0.37
TTR P02766 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL7367836 0.88 IKBKB (0.42) MAP2K4ALDH1A1CAMKK2HDAC1HDAC6
SCHEMBL7365557 0.84 MAPT (0.48) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL7364007 0.84 IDO1 (0.48) MAP2K4KDM4EALDH1A1HPGDNPC1
SCHEMBL7368926 0.78 CDK4 (0.47) KDM4EALDH1A1NPC1RAB9AMAPT
SCHEMBL7365581 0.75 CDK8 (0.48) ALDH1A1HPGDNPC1RAB9AGPR84
SCHEMBL7361974 0.73 NR4A2 (0.36) KMT2AMEN1
SCHEMBL4659229 0.72 NAPRT (0.52) KDM4EALDH1A1KMT2ACAMKK2TTR
SCHEMBL7364174 0.71 KDR (0.46) MAP2K4KDM4EALDH1A1KMT2ANPC1
SCHEMBL7366065 0.70 MIF (0.39) KDM4EALDH1A1GAAKMT2ANPC1
SCHEMBL1663134 0.70 HDAC1 (0.66) KDM4EALDH1A1TTRHDAC1HDAC6

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