SCHEMBL7408489

SCHEMBL7408489

COC(=O)c1ccc([N+](=O)[O-])[c]n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.40
MAPT P10636 4/20 0.38
KDM4E B2RXH2 3/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 2/20 0.36
ABCC4 O15439 1/20 0.36
PLIN1 O60240 1/20 0.36
CACNA1F O60840 1/20 0.36
GMNN O75496 1/20 0.36
KCNK2 O95069 1/20 0.36
ABCB11 O95342 1/20 0.36
GSR P00390 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 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
SCHEMBL20969977 0.73 MAPK1 (0.44) MAPK1MAPTKDM4EKMT2AMEN1
SCHEMBL513103 0.73 S1PR4 (0.40) MAPK1MAPTPOLBKMT2AMEN1
SCHEMBL25320720 0.71 SIRT6 (0.43) MAPK1MAPTKDM4EPOLBKMT2A
SCHEMBL31413102 0.71 SIRT6 (0.43) MAPK1MAPTKDM4EPOLBKMT2A
SCHEMBL135688 0.70 ALDH1A1 (0.43) MAPTPOLBKMT2AALDH1A1SMN1; SMN2
SCHEMBL9100291 0.70 GPR35 (0.39) MAPTKDM4EPOLBKMT2AMEN1
SCHEMBL29189923 0.69 LCK (0.43) MAPK1MAPTKDM4EPOLBKMT2A
SCHEMBL27310045 0.69 CA12 (0.39) MAPK1MAPTKDM4EPOLBKMT2A
SCHEMBL1403615 0.69 CYP2C19 (0.59) MAPK1MAPTKDM4EPOLBKMT2A
SCHEMBL27997862 0.69 POLB (0.49) MAPTPOLBKMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6011037-A Thiazole derivatives with phosphodiesterase-inhibiting action BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-01-04 US disclosed
EP-0920426-A1 NEW THIAZOLE DERIVATIVES WITH PHOSPHODIESTERASE-INHIBITING EFFECT Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1999-06-09 EP disclosed
WO-1998008830-A1 THIAZOLE DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF PDE-IV BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1998-03-05 WO disclosed
WO-1998008841-A1 NEW THIAZOLE DERIVATIVES WITH PHOSPHODIESTERASE-INHIBITING EFFECT BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1998-03-05 WO disclosed