SCHEMBL7365409

SCHEMBL7365409

COC(=O)c1ccc(-c2oc(=O)c3ccc[nH]c2-3)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 4/20 0.44
IDO1 P14902 2/20 0.44
PTPRC P08575 1/20 0.43
PTPRF P10586 1/20 0.43
PTPN1 P18031 1/20 0.43
CDC25B P30305 1/20 0.43
NPC1 O15118 4/20 0.42
MAPT P10636 4/20 0.42
RAB9A P51151 4/20 0.42
HPGD P15428 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HSD17B10 Q99714 2/20 0.42
TNKS O95271 2/20 0.41
MAPK1 P28482 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
EGFR P00533 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL7365563 0.88 CDK8 (0.46) ALDH1A1NPC1MAPTRAB9AKMT2A
SCHEMBL7366065 0.84 MIF (0.39) ALDH1A1KDM4ENPC1RAB9ATNKS
SCHEMBL7370381 0.83 NR4A2 (0.37) ALDH1A1KDM4EHPGDATM
SCHEMBL7363528 0.83 IKBKB (0.40) ALDH1A1KDM4ENPC1RAB9AHPGD
SCHEMBL7363579 0.82 MAPT (0.49) ALDH1A1KDM4EMAPTHPGDSMN1; SMN2
SCHEMBL7364846 0.79 NPC1 (0.43) ALDH1A1KDM4ENPC1MAPTRAB9A
SCHEMBL2396369 0.76 KDM4E (0.51) ALDH1A1KDM4EIDO1PTPRCPTPRF
SCHEMBL7364007 0.73 IDO1 (0.48) ALDH1A1KDM4EIDO1PTPRCPTPRF
SCHEMBL7368565 0.73 ALDH1A1 (0.50) ALDH1A1KDM4ENPC1MAPTRAB9A
SCHEMBL24727844 0.71 HDAC1 (0.63) ALDH1A1KDM4EPTPRCPTPRFPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5716954-A ANTIINFLAMMATORY AGENT, ANTIHISTAMINES, IMMUNOSUPPRESSION,AUTOIMMUNE DISEASES SYNTEX U.S.A. INC. (US) 1998-02-10 US disclosed
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