SCHEMBL11266029

SCHEMBL11266029

COC(=O)C(C)c1ccc2nc3cc(C)c(Br)cn3c(=O)c2c1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MT-CO2 P00403 1/20 0.43
ALPG P10696 1/20 0.42
PTAFR P25105 8/20 0.40
TBXAS1 P24557 12/20 0.39

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
SCHEMBL11085352 0.89 ALPG (0.40) ALPGPTAFRTBXAS1
SCHEMBL11081254 0.85 ALPG (0.48) ALPGPTAFRTBXAS1
SCHEMBL11267327 0.84 ALPG (0.49) MT-CO2ALPGPTAFRTBXAS1
SCHEMBL11266270 0.82 KDM4E (0.43) MT-CO2ALPGPTAFRTBXAS1
SCHEMBL11429362 0.81 ALPG (0.65) ALPGPTAFRTBXAS1
SCHEMBL11080644 0.81 KDM4E (0.48) ALPGPTAFRTBXAS1
SCHEMBL11269248 0.81 ALPG (0.48) ALPGPTAFRTBXAS1
SCHEMBL11080513 0.81 ALPG (0.48) ALPGPTAFRTBXAS1
SCHEMBL11297137 0.78 ALPG (0.45) ALPGPTAFRTBXAS1
SCHEMBL11076189 0.77 ALPG (0.44) ALPGPTAFRTBXAS1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0011142-B1 PYRIDO (2,1-B) QUINAZOLINONES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1982-12-29 EP claimed
EP-0011142-A1 Pyrido (2,1-b) quinazolinones, their preparation and pharmaceutical compositions containing them SCHERING AKTIENGESELLSCHAFT (DE) 1980-05-28 EP claimed
EP-0011142-A1 Pyrido (2,1-b) quinazolinones, their preparation and pharmaceutical compositions containing them SCHERING AKTIENGESELLSCHAFT (DE) 1980-05-28 EP disclosed