SCHEMBL13601846

SCHEMBL13601846

COC(=O)c1c(N)c(Cl)cc2nc(C)[nH]c12

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 6/20 0.40
RHEB Q15382 1/20 0.39
TP53 P04637 1/20 0.37
KMT2A Q03164 4/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
GAA P10253 2/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
PLA2G2A P14555 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL13601850 0.77 NQO2 (0.39) NQO2RHEBTP53KMT2AMAPT
SCHEMBL1759226 0.76 RHEB (0.44) RHEBTP53KMT2ALMNASMN1; SMN2
SCHEMBL4074971 0.74 TSHR (0.44) NQO2KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL4077018 0.73 NQO2 (0.38) NQO2KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL8953027 0.71 KDM4E (0.41) KMT2ALMNAMAPTSMN1; SMN2MEN1
SCHEMBL25259637 0.70 XDH (0.41) RHEBKMT2ALMNAMAPTSMN1; SMN2
SCHEMBL6170453 0.70 KDM4E (0.45) RHEBKMT2ALMNAMAPTSMN1; SMN2
SCHEMBL4074775 0.69 NQO2 (0.40) NQO2KMT2AMAPTSMN1; SMN2MEN1
SCHEMBL11371143 0.68 RHEB (0.38) NQO2RHEBKMT2AMAPTSMN1; SMN2
SCHEMBL21820579 0.68 XDH (0.50) RHEBKMT2ALMNASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8658801-B2 Pesticides containing a bicyclic bisamide structure SYNGENTA CROP PROTECTION, LLC (US) 2014-02-25 US disclosed
US-8658801-B2 Pesticides containing a bicyclic bisamide structure SYNGENTA CROP PROTECTION, LLC (US) 2014-02-25 US disclosed
US-20090298816-A1 PESTICIDES CONTAINING A BICYCLIC BISAMIDE STRUCTURE SYNGENTA CROP PROTECTION, INC. (US) 2009-12-03 US disclosed
US-20090298816-A1 PESTICIDES CONTAINING A BICYCLIC BISAMIDE STRUCTURE SYNGENTA CROP PROTECTION, INC. (US) 2009-12-03 US disclosed
WO-2007093402-A1 PESTICIDES CONTAINING A BICYCLIC BISAMIDE STRUCTURE SYNGENTA PARTICIPATIONS AG (CH) 2007-08-23 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 (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-20090298816-A1 PESTICIDES CONTAINING A BICYCLIC BISAMIDE STRUCTURE DDT, ACHE, GAP43 NQO2 1021/4885RHEB 4464/4885TP53 864/4885

“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.