SCHEMBL8903223

SCHEMBL8903223

CCn1nc(Cc2ccccc2)c(O)c(-c2ccccc2C)c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
RECQL P46063 1/20 0.39
GLA P06280 1/20 0.39
ELANE P08246 1/20 0.39
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TACR1 P25103 1/20 0.37
IDH1 O75874 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
SCHEMBL8902064 0.91 ADRA1A (0.40) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL8901319 0.89 MAPT (0.41) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL8902066 0.88 ADRA1A (0.43) PDE3BPDE3AALDH1A1IDH1
SCHEMBL11965008 0.87 MAPT (0.43) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL8902599 0.87 TSHR (0.40) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL11965012 0.85 RECQL (0.43) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL8903218 0.85 TACR1 (0.41) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL8902063 0.84 CASR (0.38) L3MBTL1MAPTTSHRRECQLALDH1A1
SCHEMBL8902391 0.83 ALDH1A1 (0.46) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL11965004 0.82 PDE4A (0.41) MAPTPDE4APDE4BPDE4CPDE4D

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-8188008-B2 Herbicidally and insecticidally active 4-phenyl-substituted pyridazinones BAYER CROPSCIENCE AG (DE) 2012-05-29 US disclosed
US-20100173775-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE 4-PHENYL-SUBSTITUTED PYRIDAZINONES BAYER CROPSCIENCE AG (DE) 2010-07-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100173775-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE 4-PHENYL-SUBSTITUTED PYRIDAZINONES CYP4X1, PRDX4, PRDX1 CYP1A2 39/4885CYP3A4 54/4885CYP2C9 97/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.