SCHEMBL11989372

SCHEMBL11989372

O=C1C(c2cc(-c3ccc(Cl)cc3)ccc2Cl)C(=O)N2CCOCCN12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 5/20 0.41
KDM4E B2RXH2 1/20 0.39
KMT2A Q03164 3/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
CNR2 P34972 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
MEN1 O00255 2/20 0.37
HPGD P15428 1/20 0.37
PHGDH O43175 1/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
PIK3CD O00329 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
SCHEMBL6113843 0.90 CNR2 (0.46) KMT2ASMN1; SMN2CNR2NPC1RAB9A
SCHEMBL2363015 0.87 ALDH1A1 (0.39) KMT2ACNR2NPC1RAB9ATP53
SCHEMBL6113773 0.87 KDM4E (0.41) PRKDCKDM4EKMT2ASMN1; SMN2CNR2
SCHEMBL6114040 0.87 SMN1; SMN2 (0.42) PRKDCHDAC1HDAC2SMN1; SMN2CNR2
SCHEMBL6113350 0.79 ALOX5AP (0.41)
SCHEMBL2361880 0.77 KDM4E (0.37) KDM4EKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL6113695 0.76 PGR (0.34) KDM4EKMT2ASMN1; SMN2MEN1MAPT
SCHEMBL6113846 0.76 PGR (0.42) MAPT
SCHEMBL12022374 0.74 PRKDC (0.38) PRKDCKDM4ESMN1; SMN2CNR2NPC1
SCHEMBL2363413 0.74 JAK2 (0.35) HDAC1HDAC2SMN1; SMN2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8247351-B2 Insecticidal compositions having improved effect BAYER CROPSCIENCE AG (DE) 2012-08-21 US disclosed
US-8247351-B2 Insecticidal compositions having improved effect BAYER CROPSCIENCE AG (DE) 2012-08-21 US disclosed
US-20110294783-A1 Insecticidal Compositions Having Improved Effect BAYER CROPSCIENCE AG (DE) 2011-12-01 US disclosed
US-20110294783-A1 Insecticidal Compositions Having Improved Effect BAYER CROPSCIENCE AG (DE) 2011-12-01 US disclosed
US-20090209513-A1 Insecticidal Compositions Having Improved Effect BAYER CROPSCIENCE AG (DE) 2009-08-20 US disclosed
US-20090209513-A1 Insecticidal Compositions Having Improved Effect BAYER CROPSCIENCE AG (DE) 2009-08-20 US disclosed
WO-2007068428-A2 INSECTICIDAL COMPOSITIONS CONTAINING PHENYL-SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2007-06-21 WO 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-20110294783-A1 Insecticidal Compositions Having Improved Effect FASN, CYP51A1, PIKFYVE PRKDC 2967/4885KDM4E 367/4885KMT2A 1403/4885
US-20090209513-A1 Insecticidal Compositions Having Improved Effect PTEN, PIK3CG, PIK3CD PRKDC 2496/4885KDM4E 142/4885KMT2A 874/4885

“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.