SCHEMBL7724892

SCHEMBL7724892

COC(=O)c1cc(-c2ccc(OC)c(OC)c2)nn(CC2CC2)c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K11 Q16584 1/20 0.48
DHODH Q02127 1/20 0.47
MAPT P10636 3/20 0.47
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PDE4B Q07343 7/20 0.45
PDE4A P27815 6/20 0.45
PDE4C Q08493 6/20 0.45
PDE4D Q08499 6/20 0.45
PKM P14618 2/20 0.44
ATM Q13315 2/20 0.44
USP2 O75604 1/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 2/20 0.43
LMNA P02545 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CYP2C9 P11712 1/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL7724997 0.91 CRHR1 (0.43) MAP3K11DHODHMAPTHPGDSMN1; SMN2
SCHEMBL1926744 0.91 GRIN1 (0.47) MAP3K11DHODHMAPTHPGDSMN1; SMN2
SCHEMBL7720060 0.90 HPGD (0.47) MAP3K11MAPTHPGDSMN1; SMN2PDE4B
SCHEMBL1925534 0.87 GRIN1 (0.44) DHODHMAPTHPGDSMN1; SMN2PDE4B
SCHEMBL1924728 0.83 CRHR1 (0.39) KMT2AMEN1POLB
SCHEMBL7720313 0.83 DHODH (0.49) DHODHMAPTHPGDSMN1; SMN2PDE4B
SCHEMBL1925290 0.81 GRIN1 (0.46) MAP3K11DHODHMAPTHPGDSMN1; SMN2
SCHEMBL7720083 0.81 GRIN1 (0.46) MAP3K11MAPTHPGDSMN1; SMN2
SCHEMBL7723538 0.81 CNR2 (0.44) MAP3K11MAPTHPGDSMN1; SMN2
SCHEMBL7720077 0.78 CASP1 (0.48) MAPTHPGDKMT2ALMNAALDH1A1

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
US-6403586-B1 Pyridazine derivatives and drugs containing the same as the active ingredient KOWA CO., LTD. (JP) 2002-06-11 US disclosed
EP-1061077-A1 NOVEL PYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Kowa Co., Ltd. (JP) 2000-12-20 EP disclosed