SCHEMBL2902947

SCHEMBL2902947

Cc1ccccc1-n1nc[c]c1C(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.37
TSHR P16473 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.35
LMNA P02545 4/20 0.34
HTT P42858 3/20 0.34
KMT2A Q03164 2/20 0.34
HIF1A Q16665 2/20 0.34
TP53 P04637 2/20 0.34
GSK3B P49841 2/20 0.34
FLT3 P36888 1/20 0.34
MAPK14 Q16539 1/20 0.34
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 1/20 0.33
MGLL Q99685 1/20 0.33
HPGD P15428 1/20 0.33
TDP1 Q9NUW8 2/20 0.32

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
SCHEMBL2902936 0.81 KCNN4 (0.35) ALDH1A1LMNATP53GSK3BMAPK14
SCHEMBL2897537 0.81 MGLL (0.33) MGLL
SCHEMBL2894797 0.80 ALDH1A1 (0.37) ALDH1A1TSHRL3MBTL1LMNAHTT
SCHEMBL2897672 0.79 ALDH1A1 (0.40) ALDH1A1L3MBTL1LMNAHTTKMT2A
SCHEMBL2897551 0.78 ALDH1A1 (0.42) ALDH1A1TSHRL3MBTL1LMNAHTT
SCHEMBL3392199 0.76 POLB (0.36) ALDH1A1L3MBTL1LMNAHTTKMT2A
SCHEMBL2897492 0.74 ALDH1A1 (0.37) ALDH1A1TSHRL3MBTL1LMNAHTT
SCHEMBL2902968 0.74
SCHEMBL1303649 0.71 RAB9A (0.38) TP53SMN1; SMN2MAPTHPGDCYP1A2
SCHEMBL2897587 0.71 KCNN4 (0.36) L3MBTL1MGLLTDP1

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 ALDH1A1 551/4885TSHR 2740/4885L3MBTL1 1263/4885

“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.