SCHEMBL2285273

SCHEMBL2285273

COc1c[c]cc(Br)c1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
ALOX5 P09917 1/20 0.33
PTGS2 P35354 1/20 0.33
PRKDC P78527 1/20 0.32
ALDH1A1 P00352 2/20 0.32
PRNP P04156 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
LCK P06239 1/20 0.31
FYN P06241 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NQO2 P16083 2/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31

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
SCHEMBL312352 0.83 CA12 (0.36) POLBMAPTALDH1A1RXFP1ACHE
SCHEMBL146104 0.83
SCHEMBL2285003 0.79 MAPT (0.39) L3MBTL1POLBMAPTNPSR1ALOX5
SCHEMBL943918 0.77 CA2 (0.41) L3MBTL1POLBMAPTNPSR1ALOX5
SCHEMBL2287683 0.76 ACHE (0.32) ACHE
SCHEMBL2291601 0.76 POLB (0.34) L3MBTL1POLBMAPTNPSR1ALOX5
SCHEMBL1298973 0.76 ALOX5 (0.50) L3MBTL1POLBMAPTNPSR1ALOX5
SCHEMBL2286239 0.76 POLB (0.34) L3MBTL1POLBMAPTNPSR1ALOX5
SCHEMBL1578724 0.75 MAPT (0.38) L3MBTL1POLBMAPTNPSR1ALOX5
SCHEMBL2285774 0.73 TUBB1 (0.34) ACHE

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-7989394-B2 Substituted 1-(azolin-2-yl)-amino-2-aryl-1-hetaryl-ethane compounds BASF SE (DE) 2011-08-02 US disclosed
US-20090131256-A1 Substituted 1-(azolin-2-yl)-amino-2-aryl-1-hetaryl-ethane Compounds BASF SE (DE) 2009-05-21 US 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-20090131256-A1 Substituted 1-(azolin-2-yl)-amino-2-aryl-1-hetaryl-ethane Compounds AAAS, AIPL1, ATXN2 L3MBTL1 1463/4885POLB 4882/4885MAPT 4268/4885

“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.