SCHEMBL2900508

SCHEMBL2900508

COc1ccc(C(=O)N(C)c2cccnc2)cc1-n1cccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.45
KMT2A Q03164 5/20 0.41
KDM4E B2RXH2 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 4/20 0.41
GAA P10253 2/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 3/20 0.40
CYP2C19 P33261 2/20 0.40
HSD17B10 Q99714 1/20 0.40
ABCB1 P08183 1/20 0.40
ABCC1 P33527 1/20 0.40
GPBAR1 Q8TDU6 1/20 0.39
CYP2D6 P10635 1/20 0.39
NOTUM Q6P988 1/20 0.39
CYP1A1 P04798 1/20 0.39

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
SCHEMBL12978266 0.83 ALDH1A1 (0.57) TRPV1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL2903493 0.80 HTT (0.52) TRPV1KMT2AKDM4ENPSR1HPGD
SCHEMBL12978300 0.76 ALDH1A1 (0.56) TRPV1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL13095759 0.76 TRPV1 (0.47) TRPV1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL12978032 0.75 TRPV1 (0.51) TRPV1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL12978307 0.74 MAPK1 (0.47) TRPV1KMT2AKDM4EALDH1A1MEN1
SCHEMBL12978035 0.74 GAA (0.54) TRPV1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL12978302 0.74 MAPK1 (0.47) TRPV1KMT2ANPSR1ALDH1A1MEN1
SCHEMBL12978336 0.74 TRPV1 (0.49) TRPV1KMT2ANPSR1ALDH1A1MEN1
SCHEMBL12978342 0.73 KMT2A (0.50) TRPV1KMT2ANPSR1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
WO-2010112177-A1 ACYLATED AMINOPYRIDINES AND AMINOPYRIDAZINES AS INSECTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-10-07 WO disclosed
EP-2236505-A1 Acylated aminopyridines and pyridazines as insecticides Bayer CropScience AG (DE) 2010-10-06 EP disclosed
EP-2236505-A1 Acylated aminopyridines and pyridazines as insecticides Bayer CropScience AG (DE) 2010-10-06 EP 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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR TRPV1 2769/4885KMT2A 412/4885KDM4E 762/4885

“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.