SCHEMBL2690961

SCHEMBL2690961

N#CCNc1cn(-c2cccnc2)nc1Cl

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 3/20 0.36
CYP2A6 P11509 4/20 0.36
IRAK4 Q9NWZ3 3/20 0.35
KDR P35968 1/20 0.35
CYP3A4 P08684 2/20 0.34
CYP2E1 P05181 2/20 0.34
GAA P10253 1/20 0.34
PIK3CD O00329 4/20 0.33
MAPK1 P28482 1/20 0.33
ELANE P08246 1/20 0.33
MAP3K8 P41279 1/20 0.33

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
SCHEMBL14891984 0.87 CYP2A6 (0.36) MAT2ACYP2A6IRAK4KDRCYP3A4
SCHEMBL15346459 0.86 CYP2A6 (0.35) MAT2ACYP2A6IRAK4KDRCYP3A4
SCHEMBL2692307 0.85 MAT2A (0.41) MAT2ACYP2A6IRAK4KDRCYP3A4
Hydrochloric Acid SCHEMBL2688884 0.84 MAT2A (0.40) MAT2ACYP2A6IRAK4KDRCYP3A4
Ammonia Solution, Strong SCHEMBL20569938 0.84 MAT2A (0.40) MAT2ACYP2A6IRAK4KDRCYP3A4
Hydrochloric Acid SCHEMBL15346752 0.84 MAT2A (0.40) MAT2ACYP2A6IRAK4KDRCYP3A4
SCHEMBL2691119 0.84 CYP2A6 (0.41) MAT2ACYP2A6IRAK4CYP3A4CYP2E1
SCHEMBL2690355 0.83 PKM (0.42) MAT2ACYP2A6IRAK4KDRCYP3A4
Hydrochloric Acid SCHEMBL15346651 0.82 CYP2A6 (0.41) MAT2ACYP2A6IRAK4KDRCYP3A4
Hydrochloric Acid SCHEMBL28067430 0.82 CYP2A6 (0.41) MAT2ACYP2A6IRAK4KDRCYP3A4

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200055846-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2020-02-20 US disclosed
US-10165775-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2019-01-01 US disclosed
US-20170267657-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2017-09-21 US disclosed
US-9708288-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-07-18 US disclosed
US-20170181432-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2017-06-29 US disclosed
US-9655365-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-05-23 US disclosed
US-9591857-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-03-14 US disclosed
US-20160318924-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2016-11-03 US disclosed
US-9422278-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2016-08-23 US disclosed
US-20160159766-A9 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2016-06-09 US disclosed
US-20140162874-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-06-12 US disclosed
WO-2013162716-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-10-31 WO disclosed
US-20130291227-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-10-31 US disclosed
WO-2013162715-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-10-31 WO disclosed
US-20130288893-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-10-31 US disclosed
EP-2635278-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO Dow AgroSciences LLC (US) 2013-09-11 EP disclosed
WO-2013062981-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-05-02 WO disclosed
US-20130109566-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-05-02 US disclosed
WO-2012061290-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2012-05-10 WO disclosed
US-20120110702-A1 Pesticidal Compositions and Processes Related Thereto CORTEVA AGRISCIENCE LLC 2012-05-03 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 (11 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-20130109566-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885
US-20160318924-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885
US-20160159766-A9 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885
US-20130291227-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885
US-20170181432-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885
US-20200055846-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885
US-20170267657-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885
US-20140162874-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885
US-10165775-B2 Pesticidal compositions and processes related thereto ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885
US-20120110702-A1 Pesticidal Compositions and Processes Related Thereto ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885
US-20130288893-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS MAT2A 1242/4885CYP2A6 368/4885IRAK4 4011/4885

“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.