SCHEMBL7363579

SCHEMBL7363579

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.49
ATR Q13535 1/20 0.45
CECR2 Q9BXF3 4/20 0.44
TAF1 P21675 3/20 0.41
NCOA1 Q15788 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
JAK3 P52333 1/20 0.39
CYP2D6 P10635 2/20 0.38
OPRD1 P41143 1/20 0.38
KCNH2 Q12809 1/20 0.38
KAT8 Q9H7Z6 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
BRD4 O60885 4/20 0.37
BRD9 Q9H8M2 2/20 0.37
TRIM24 O15164 1/20 0.37
SMARCA2 P51531 1/20 0.37
SMARCA4 P51532 1/20 0.37
BRPF1 P55201 1/20 0.37

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
SCHEMBL7366065 0.84 MIF (0.39) JAK3CYP2D6ALDH1A1KDM4EMEN1
SCHEMBL7363528 0.83 IKBKB (0.40) CYP2D6OPRD1KCNH2CREBBPALDH1A1
SCHEMBL7365409 0.82 ALDH1A1 (0.44) MAPTOPRD1KCNH2ALDH1A1HPGD
SCHEMBL7364846 0.79 NPC1 (0.43) MAPTALDH1A1HPGDKDM4ECYP3A4
SCHEMBL7367312 0.76 ALDH1A1 (0.47) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL7365557 0.73 MAPT (0.48) MAPTATRCECR2TAF1NCOA1
SCHEMBL7365563 0.72 CDK8 (0.46) MAPTPDK2ALDH1A1KMT2AERN1
SCHEMBL7370381 0.71 NR4A2 (0.37) CREBBPALDH1A1HPGDKDM4E
SCHEMBL7361674 0.68 MAOB (0.42) MAPTNCOA1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL7359478 0.68 MIF (0.42) MAPTBRD4ALDH1A1HPGDKDM4E

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