SCHEMBL2901239

SCHEMBL2901239

[c]1ccc(Cn2cc(-c3ncccn3)cn2)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
CREBBP Q92793 8/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
KCNH2 Q12809 2/20 0.40
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
DYRK1B Q9Y463 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
FYN P06241 1/20 0.38
COMT P21964 1/20 0.37
MAPK1 P28482 1/20 0.37
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
PI4KA P42356 1/20 0.36
PIK3CG P48736 1/20 0.36
PI4KB Q9UBF8 1/20 0.36

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
SCHEMBL2900642 0.84 CREBBP (0.52) L3MBTL1CREBBPADORA2AADORA1DYRK1B
SCHEMBL2901154 0.82 L3MBTL1 (0.46) L3MBTL1CREBBPCYP3A4CYP2C9KCNH2
SCHEMBL2902778 0.72 HSD17B10 (0.59) L3MBTL1DYRK1BMAPK1
SCHEMBL2893971 0.72 NPC1 (0.43) L3MBTL1
SCHEMBL2900500 0.70 LMNA (0.41) L3MBTL1CREBBPKCNH2ADORA2AADORA1
SCHEMBL25423530 0.69 L3MBTL1 (0.71) L3MBTL1CREBBPKCNH2ADORA2AADORA1
SCHEMBL1569847 0.68 MAPT (0.56)
SCHEMBL533167 0.68 CLK4 (0.46) CYP3A4MAPK1PIK3CDPI4KAPIK3CG
SCHEMBL3289673 0.68 L3MBTL1 (0.56) L3MBTL1CREBBPADORA2AADORA1DYRK1B
SCHEMBL4784136 0.68 L3MBTL1 (0.60) L3MBTL1CREBBPCYP2C9ADORA2AADORA1

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 L3MBTL1 1263/4885CREBBP 3229/4885CYP3A4 87/4885

“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.