SCHEMBL2900588

SCHEMBL2900588

COC(C)(OC)c1[c]cnn1-c1ccc(Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
PTGS1 P23219 4/20 0.36
PTGS2 P35354 4/20 0.36
HIF1A Q16665 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
THPO P40225 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
NPBWR1 P48145 2/20 0.35
KDM4E B2RXH2 3/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
NOTUM Q6P988 1/20 0.34
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33

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
SCHEMBL2897589 0.83 MPO (0.44) NPSR1NPBWR1KDM4EGAAHTT
SCHEMBL2897469 0.80 L3MBTL1 (0.38) NPSR1
SCHEMBL885439 0.78 PTGS1 (0.43) PTGS1PTGS2HIF1ANPSR1CYP1A2
SCHEMBL2895233 0.77 KCNN4 (0.35) GAASMN1; SMN2MEN1KMT2A
SCHEMBL2901143 0.73 CYP17A1 (0.37) CYP1A2
SCHEMBL2347651 0.72 NPC1 (0.42) POLBPTGS2TSHRNPBWR1GAA
SCHEMBL16927664 0.68 PTGS2 (0.47) PTGS1PTGS2HIF1ANPSR1CYP1A2
SCHEMBL1904592 0.67 ALDH1A1 (0.38) POLBNPSR1CYP1A2CYP2C19KDM4E
SCHEMBL4909316 0.66 MAPT (0.37) POLBNPSR1CYP1A2CYP2C9TSHR
SCHEMBL1304888 0.65 NPBWR1 (0.39) PTGS1PTGS2NPSR1CYP1A2CYP3A4

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 POLB 2949/4885PTGS1 1616/4885PTGS2 1684/4885

“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.