SCHEMBL2900720

SCHEMBL2900720

COc1cc[c]cc1-n1cccn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 3/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
G6PD P11413 1/20 0.39
NPC1 O15118 2/20 0.38
MAPK1 P28482 1/20 0.38
DRD2 P14416 2/20 0.36
DRD4 P21917 2/20 0.36
DRD3 P35462 2/20 0.36
RAB9A P51151 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP2D6 P10635 1/20 0.35
NPBWR1 P48145 1/20 0.35
NOTUM Q6P988 1/20 0.34
TDO2 P48775 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
SCHEMBL6984312 0.78 NPC1 (0.51) MEN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL27945389 0.76 ALDH1A1 (0.42) MEN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL27934781 0.76 TDO2 (0.44) MEN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL2895222 0.75 CYP19A1 (0.31)
SCHEMBL2897530 0.74 DYRK1B (0.37) DRD2DRD4DRD3
SCHEMBL14951066 0.73 KMT2A (0.55) MEN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL2900518 0.73 PRKCI (0.36) ALDH1A1KDM4EDRD2DRD4DRD3
SCHEMBL2902569 0.73 ALDH1A1 (0.34) ALDH1A1MAPTKDM4EDRD2DRD4
SCHEMBL2902854 0.73 GRM5 (0.43) ALDH1A1MAPTKDM4ELMNAGAA
SCHEMBL161297 0.72 ALDH1A1 (0.42) MEN1ALDH1A1MAPTKMT2AKDM4E

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 2 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
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 MEN1 2671/4885ALDH1A1 551/4885MAPT 3480/4885

“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.