SCHEMBL2903210

SCHEMBL2903210

COc1cc[c]cc1NC(=O)C1CCCC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.64
TSHR P16473 2/20 0.56
ALOX15 P16050 1/20 0.52
KDM4E B2RXH2 5/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
RAB9A P51151 2/20 0.49
USP2 O75604 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
NPC1 O15118 1/20 0.47
CYP1A2 P05177 1/20 0.47
PKM P14618 1/20 0.47
CYP2C19 P33261 1/20 0.47
STK17B O94768 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ACHE P22303 1/20 0.45

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
SCHEMBL1355851 0.94 SMN1; SMN2 (0.56) SMN1; SMN2TSHRALOX15KDM4EALDH1A1
SCHEMBL2893938 0.82 GAA (0.52) SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL14503304 0.78 SMN1; SMN2 (1.00) SMN1; SMN2TSHRALOX15KDM4EALDH1A1
SCHEMBL1355596 0.77 ALDH1A1 (0.45) SMN1; SMN2TSHRKDM4EALDH1A1RAB9A
SCHEMBL2901793 0.76 ALDH1A1 (0.45) KDM4EALDH1A1HPGDRAB9AKMT2A
SCHEMBL2893787 0.75 KMT2A (0.50) SMN1; SMN2TSHRALOX15ALDH1A1HPGD
SCHEMBL1916986 0.75 KMT2A (0.70) SMN1; SMN2TSHRKDM4EALDH1A1HSD17B10
SCHEMBL2900503 0.75 KDM4E (0.48) TSHRKDM4EALDH1A1NPSR1MAPT
SCHEMBL26154084 0.74 KMT2A (0.69) SMN1; SMN2TSHRKDM4EALDH1A1HSD17B10
SCHEMBL2902879 0.74 HTT (0.46) TSHRKDM4EALDH1A1HPGDHSD17B10

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 SMN1; SMN2 2519/4885TSHR 2740/4885ALOX15 2683/4885

“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.