SCHEMBL19211883

SCHEMBL19211883

COC(=O)c1ncc(C(=O)N(C)c2cccnc2)n1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
NOTUM Q6P988 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
GAA P10253 1/20 0.36
NR4A2 P43354 1/20 0.35
CYP3A4 P08684 1/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NAMPT P43490 2/20 0.35
MLYCD O95822 1/20 0.35
HPGD P15428 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
CYP19A1 P11511 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL20732773 0.87 NOTUM (0.47) ALDH1A1NOTUMTRPV1GAACYP3A4
SCHEMBL19211797 0.87 NOTUM (0.41) ALDH1A1NOTUMTRPV1KMT2AKDM4E
SCHEMBL20733023 0.86 TRPV1 (0.44) NOTUMTRPV1GAACYP3A4KMT2A
SCHEMBL21056147 0.84 NOTUM (0.39) ALDH1A1NOTUMTRPV1GAACYP3A4
SCHEMBL20718652 0.84 TRPV1 (0.46) ALDH1A1NOTUMTRPV1GAAKMT2A
SCHEMBL19211846 0.83 TRPV1 (0.41) NOTUMTRPV1CYP3A4KMT2AKDM4E
SCHEMBL19254991 0.83 NAMPT (0.54) ALDH1A1NAMPTCYP11B2
SCHEMBL19211888 0.83 TRPV1 (0.44) NOTUMTRPV1GAAKMT2ANAMPT
SCHEMBL19255739 0.82 NAMPT (0.47) ALDH1A1NOTUMGAANAMPTCYP11B2
SCHEMBL19254992 0.82 TRPV1 (0.39) ALDH1A1NOTUMTRPV1GAANAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3414238-B1 SUBSTITUTED IMIDAZOLYL-CARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2021-03-24 EP disclosed
EP-3414238-B1 SUBSTITUTED IMIDAZOLYL-CARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2021-03-24 EP disclosed
EP-3497101-B1 SUBSTITUTED 2-HETEROCYCLYL IMIDAZOLYL-CARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2020-12-30 EP disclosed
EP-3497101-B1 SUBSTITUTED 2-HETEROCYCLYL IMIDAZOLYL-CARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2020-12-30 EP disclosed
US-10660333-B2 Substituted 2-heterocyclylimidazolylcarboxamides as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-05-26 US disclosed
US-10660333-B2 Substituted 2-heterocyclylimidazolylcarboxamides as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-05-26 US disclosed
US-10349657-B2 Substituted imidazolylcarboxamides as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-07-16 US disclosed
US-10349657-B2 Substituted imidazolylcarboxamides as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-07-16 US disclosed
EP-3497101-A1 SUBSTITUTED 2-HETEROCYCLYL IMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS Bayer CropScience Aktiengesellschaft (DE) 2019-06-19 EP disclosed
US-20190166837-A1 SUBSTITUTED 2-HETEROCYCLYLIMIDAZOLYLCARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-06-06 US disclosed
US-20190166837-A1 SUBSTITUTED 2-HETEROCYCLYLIMIDAZOLYLCARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-06-06 US disclosed
US-20190045783-A1 SUBSTITUTED IMIDAZOLYLCARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-02-14 US disclosed
US-20190045783-A1 SUBSTITUTED IMIDAZOLYLCARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-02-14 US disclosed
EP-3414238-A1 SUBSTITUTED -OXYIMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS Bayer CropScience Aktiengesellschaft (DE) 2018-12-19 EP disclosed
WO-2018029102-A1 SUBSTITUTED 2-HETEROCYCLYL IMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-02-15 WO disclosed
WO-2017137319-A1 SUBSTITUTED -OXYIMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-08-17 WO disclosed
WO-2017137319-A1 SUBSTITUTED -OXYIMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-08-17 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 (4 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-20190045783-A1 SUBSTITUTED IMIDAZOLYLCARBOXAMIDES AS PESTICIDES DDT, CYCS, TSNAX ALDH1A1 3492/4885NOTUM 421/4885TRPV1 1427/4885
US-20190166837-A1 SUBSTITUTED 2-HETEROCYCLYLIMIDAZOLYLCARBOXAMIDES AS PESTICIDES DDT, PTMS, TSNAX ALDH1A1 3634/4885NOTUM 544/4885TRPV1 2388/4885
US-10660333-B2 Substituted 2-heterocyclylimidazolylcarboxamides as pesticides DDT, PTMS, TSNAX ALDH1A1 3634/4885NOTUM 544/4885TRPV1 2388/4885
US-10349657-B2 Substituted imidazolylcarboxamides as pesticides DDT, CYCS, TSNAX ALDH1A1 3492/4885NOTUM 421/4885TRPV1 1427/4885

“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.