SCHEMBL12409136

SCHEMBL12409136

CC1(c2cc(Cl)cc(Cl)c2)CC(c2cccc(CN3C(=O)c4ccccc4C3=O)c2)=NO1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
MAPT P10636 3/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
HPGD P15428 1/20 0.40
PRKDC P78527 2/20 0.40
CASP6 P55212 1/20 0.40
RECQL P46063 1/20 0.39
TYR P14679 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
PKM P14618 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CASP3 P42574 1/20 0.38
ACHE P22303 2/20 0.37
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 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
SCHEMBL12489682 0.84 KDM4E (0.39) KDM4EMAPTMAPK1KMT2AMEN1
SCHEMBL1860093 0.74 PKM (0.38) KMT2APRKDCPKMTSHRSMN1; SMN2
SCHEMBL1305247 0.69 GRM5 (0.33) MAPTKMT2ARECQLTYRPKM
SCHEMBL18669170 0.68 KDM4E (0.73) KDM4EMAPTMAPK1KMT2AMEN1
SCHEMBL12198519 0.66 RECQL (0.40) KDM4EMAPTMAPK1RECQLPKM
SCHEMBL12394977 0.66 RECQL (0.42) KDM4EMAPTRECQLCA1CA2
SCHEMBL2258501 0.66 KMT2A (0.70) KDM4EMAPTMAPK1KMT2AMEN1
SCHEMBL16261603 0.65 KDM4E (0.41) KDM4EMAPTRECQLCA1CA2
SCHEMBL16256398 0.65 RECQL (0.39) KDM4EMAPTRECQLCA1CA2
SCHEMBL2010809 0.65 RECQL (0.44) KDM4EMAPTRECQLCA1CA2

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-20130137876-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2013-05-30 US disclosed
US-8362257-B2 Nitrogen-containing heterocyclic compound and pest control agent NIPPON SODA CO., LTD. (JP) 2013-01-29 US disclosed
US-20110166358-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2011-07-07 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-20130137876-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND PEST CONTROL AGENT CBR3, CBR1, NOXO1 KDM4E 1194/4885MAPT 4670/4885MAPK1 2120/4885
US-20110166358-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND PEST CONTROL AGENT CBR3, CBR1, NOXO1 KDM4E 1194/4885MAPT 4670/4885MAPK1 2120/4885

“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.