SCHEMBL2136286

SCHEMBL2136286

COC(=O)c1nc(Cl)cc(NCc2cccnc2)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
CDK5 Q00535 1/20 0.47
CDK5R1 Q15078 1/20 0.47
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
KMT2A Q03164 2/20 0.47
TSHR P16473 2/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
PLAU P00749 2/20 0.44
EGFR P00533 1/20 0.44
TP53 P04637 1/20 0.44
PGK1 P00558 1/20 0.43

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
SCHEMBL2135021 0.87 CA1 (0.47) SMN1; SMN2KDM4EALDH1A1KMT2AHPGD
SCHEMBL2137567 0.86 KMT2A (0.47) SMN1; SMN2KDM4EALDH1A1KMT2AHPGD
SCHEMBL10206279 0.84 KDM4E (0.43) SMN1; SMN2KDM4EALDH1A1KMT2ATSHR
SCHEMBL2133084 0.82 MEN1 (0.47) ALDH1A1KMT2AMEN1MAPT
SCHEMBL2137037 0.82 ADORA2B (0.43) KDM4EGAAMAPT
SCHEMBL24363124 0.81 ALDH1A1 (0.53) SMN1; SMN2CDK5CDK5R1KDM4EALDH1A1
SCHEMBL2134013 0.79 KCNQ3 (0.49) SMN1; SMN2KDM4EALDH1A1GAAMAPT
SCHEMBL2136669 0.79 ADORA2A (0.43)
SCHEMBL1466169 0.78 ALDH1A1 (0.55) SMN1; SMN2KDM4EALDH1A1KMT2ATSHR
SCHEMBL2136869 0.78 KDM4E (0.46) SMN1; SMN2KDM4EALDH1A1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445884-B1 4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA LTD (GB) 2013-02-13 EP disclosed
US-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-04-26 US disclosed
US-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-04-26 US disclosed
US-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-04-26 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 (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-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES DDT, DAO, NPM1 SMN1; SMN2 3068/4885CDK5 1012/4885CDK5R1 2212/4885

“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.