SCHEMBL2930133

SCHEMBL2930133

COC(=O)c1cc2nc[nH]c2c(Cl)c1N

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 6/20 0.46
ABL1 P00519 1/20 0.40
KDM4E B2RXH2 4/20 0.39
POLB P06746 1/20 0.39
GAA P10253 2/20 0.38
TSHR P16473 1/20 0.38
NR4A2 P43354 3/20 0.36
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
ATM Q13315 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
SCHEMBL2936494 0.82 CYP3A4 (0.38) KDM4EALDH1A1MAPT
SCHEMBL13601850 0.78 NQO2 (0.39) NQO2ABL1KDM4EGAAMAPT
SCHEMBL13697796 0.77 KDM4E (0.36) NQO2KDM4EGAAALDH1A1MAPT
SCHEMBL13515354 0.76 NQO2 (0.44) NQO2ABL1KDM4EPOLBGAA
SCHEMBL2936605 0.74 NQO2 (0.48) NQO2ABL1KDM4EPOLBGAA
SCHEMBL25395312 0.72 NR4A2 (0.41) GAATSHRNR4A2ALDH1A1HSD17B10
SCHEMBL6185365 0.72 KDM4E (0.44) KDM4EPOLBGAAALDH1A1GLA
SCHEMBL8802475 0.72 KDM4E (0.54) NQO2ABL1KDM4EGAATSHR
SCHEMBL30591117 0.72 NR4A2 (0.41) GAATSHRNR4A2ALDH1A1HSD17B10
SCHEMBL21820606 0.71 NQO2 (0.42) NQO2KDM4EALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580785-B2 Insecticides SYNGENTA CROP PROTECTION LLC (US) 2013-11-12 US disclosed
US-8580785-B2 Insecticides SYNGENTA CROP PROTECTION LLC (US) 2013-11-12 US disclosed
US-8580785-B2 Insecticides SYNGENTA CROP PROTECTION LLC (US) 2013-11-12 US disclosed
CN-101273029-B Bicyclic bisamide derivatives and their use as pesticides SYNGENTA PARTICIPATIONS AG (CH) 2013-03-27 CN disclosed
EP-1919903-B1 BICYCLIC BISAMIDE DERIVATIVES AND USE THEREOF AS INSECTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-01-27 EP disclosed
US-20090221587-A1 NOVEL INSECTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2009-09-03 US disclosed
US-20090221587-A1 NOVEL INSECTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2009-09-03 US disclosed
EP-1919903-A2 BICYCLIC BISAMIDE DERIVATIVES AND USE THEREOF AS INSECTICIDES Syngeta Participations AG (CH) 2008-05-14 EP disclosed
WO-2007020050-A2 BICYCLIC BISAMIDE DERIVATIVES AND USE THEREOF AS INSECTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2007-02-22 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-20090221587-A1 NOVEL INSECTICIDES DDT, CYP4F11, ACHE NQO2 2386/4885ABL1 819/4885KDM4E 3002/4885

“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.