SCHEMBL11965013

SCHEMBL11965013

Cc1ccccc1-c1c(O)c(C(C)C)nn(C)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
BRD4 O60885 1/20 0.41
TDP2 O95551 1/20 0.39
ELANE P08246 1/20 0.39
MAPK13 O15264 1/20 0.35
EIF2AK2 P19525 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
MAPK14 Q16539 1/20 0.35
CDK8 P49336 1/20 0.35
ACVR1 Q04771 1/20 0.35
HPGD P15428 2/20 0.35
LDHA P00338 1/20 0.35
DHODH Q02127 1/20 0.35
TP53 P04637 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL11965016 0.84 ELANE (0.38) SMN1; SMN2LMNABRD4TDP2ELANE
SCHEMBL11965000 0.84 CDK8 (0.44) BRD4TDP2ELANECDK8ACVR1
SCHEMBL11965014 0.83 PTGS2 (0.38) SMN1; SMN2LMNABRD4ELANEKDM4E
SCHEMBL11965018 0.82 MAPT (0.36) SMN1; SMN2LMNABRD4ELANEDHODH
SCHEMBL8901211 0.80 CASR (0.43) SMN1; SMN2TP53TACR1
SCHEMBL12603551 0.80 MAPT (0.37) LMNABRD4HPGDALDH1A1USP2
SCHEMBL8902971 0.79 PDE5A (0.44) ALDH1A1TACR1MEN1KMT2A
SCHEMBL8902897 0.79 ELANE (0.34) BRD4ELANELDHADHODHTACR1
SCHEMBL11965007 0.79 HEXA (0.43) SMN1; SMN2LMNABRD4TDP2ELANE
SCHEMBL8902320 0.78 CMKLR1 (0.35) SMN1; SMN2LMNABRD4ELANEHPGD

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-8242055-B2 Herbicidally and insecticidally active phenyl-substituted pyridazinones BAYER CROPSCIENCE AG (DE) 2012-08-14 US disclosed
US-20110118118-A1 HERBICIDALLY ACTIVE PHENYL-SUBSTITUTED PYRIDAZINONES BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
US-20100184602-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE PHENYL-SUBSTITUTED PYRIDAZINONES BAYER CROPSCIENCE AG (DE) 2010-07-22 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 (2 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-20100184602-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE PHENYL-SUBSTITUTED PYRIDAZINONES CYP4X1, PRDX1, PNPO SMN1; SMN2 3492/4885LMNA 1586/4885BRD4 1739/4885
US-20110118118-A1 HERBICIDALLY ACTIVE PHENYL-SUBSTITUTED PYRIDAZINONES PNPO, PDXK, PRDX1 SMN1; SMN2 3364/4885LMNA 1422/4885BRD4 2323/4885

“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.