SCHEMBL2903348

SCHEMBL2903348

COCc1[c]cnn1-c1ccccc1Br

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
IDO1 P14902 2/20 0.31
SLC5A1 P13866 1/20 0.31
SLC5A2 P31639 1/20 0.31
OPRM1 P35372 1/20 0.30
MGLL Q99685 1/20 0.30

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
SCHEMBL2896694 0.82 PDE4B (0.40) ALDH1A1
SCHEMBL2897572 0.80 LMNA (0.39) MEN1ALDH1A1KMT2AIDO1SLC5A1
SCHEMBL2903061 0.74 HCAR1 (0.42) ALDH1A1TSHRSLC5A1SLC5A2OPRM1
SCHEMBL2900595 0.71 CNR2 (0.39) NPSR1OPRM1
SCHEMBL2903261 0.71 TUBB4A (0.32)
SCHEMBL2900240 0.69 EPHX2 (0.40) ALDH1A1
SCHEMBL2897911 0.68 IDO1 (0.37) IDO1MGLL
SCHEMBL2897537 0.68 MGLL (0.33) MGLL
SCHEMBL2901115 0.65 KDM4E (0.32) HTTNPSR1
SCHEMBL1146014 0.64 IDO1 (0.61) MEN1ALDH1A1TSHRHTTKMT2A

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 MEN1 2671/4885ALDH1A1 551/4885TSHR 2740/4885

“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.