SCHEMBL7724840

SCHEMBL7724840

COc1ccc(-c2cc(C(N)=O)c(=O)n(Cc3ccccc3)n2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.61
ADORA2A P29274 1/20 0.54
PDE4A P27815 2/20 0.52
PDE4B Q07343 2/20 0.52
PDE4C Q08493 2/20 0.52
PDE4D Q08499 2/20 0.52
CASP1 P29466 1/20 0.51
HDAC1 Q13547 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
ASIC1 P78348 1/20 0.48
BCHE P06276 1/20 0.48
ALDH1A1 P00352 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL7723670 0.91 MAPT (0.63) MAPTADORA2APDE4APDE4BPDE4C
SCHEMBL7720271 0.89 MAPT (0.64) MAPTADORA2APDE4APDE4BPDE4C
SCHEMBL7720270 0.87 MAPT (0.59) MAPTADORA2APDE4APDE4BPDE4C
SCHEMBL7720258 0.87 MAPT (0.59) MAPTADORA2APDE4APDE4BPDE4C
SCHEMBL7724966 0.86 MAPT (0.76) MAPTADORA2APDE4APDE4BPDE4C
SCHEMBL7726116 0.84 ADORA2A (0.61) MAPTADORA2APDE4APDE4BPDE4C
SCHEMBL7724772 0.82 CASP1 (0.44) MAPTADORA2ACASP1ASIC1ALDH1A1
SCHEMBL7724774 0.82 CASP1 (0.44) MAPTADORA2ACASP1ASIC1ALDH1A1
SCHEMBL7720244 0.81 MAPT (0.51) MAPTADORA2AHDAC1SMN1; SMN2CYP1A2
SCHEMBL7720077 0.80 CASP1 (0.48) MAPTCASP1ALDH1A1LMNAHTT

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