SCHEMBL2900554

SCHEMBL2900554

COc1cc(OC)nc(Oc2cc[c]cc2)n1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.70
SMN1; SMN2 Q16637 2/20 0.53
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP3A4 P08684 1/20 0.39
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL9767808 0.81 L3MBTL1 (0.75) L3MBTL1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL2894729 0.80 L3MBTL1 (0.57) L3MBTL1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL12095206 0.79 L3MBTL1 (0.72) L3MBTL1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL1120954 0.78 L3MBTL1 (0.76) L3MBTL1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL27470168 0.78 L3MBTL1 (0.76) L3MBTL1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL2900809 0.77 L3MBTL1 (0.50) L3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL2902967 0.77 HTT (0.53) L3MBTL1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL21316935 0.75 L3MBTL1 (0.71) L3MBTL1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL28411595 0.74 L3MBTL1 (0.69) L3MBTL1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL2897541 0.74 P2RX3 (0.40) L3MBTL1SMN1; SMN2ALDH1A1MEN1KMT2A

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 1263/4885SMN1; SMN2 2519/4885ALDH1A1 551/4885

“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.