SCHEMBL22201410

SCHEMBL22201410

CCCCc1nc2ccc(Nc3nc(-c4ccncc4)nc4ncccc34)cc2o1

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 20/20 0.47

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
SCHEMBL22201409 0.95 ABCG2 (0.48) ABCG2
SCHEMBL22201414 0.91 ABCG2 (0.50) ABCG2
SCHEMBL22201458 0.88 ALDH1A1 (0.55) ABCG2
SCHEMBL22201413 0.84 ABCG2 (0.53) ABCG2
SCHEMBL22201411 0.81 ABCG2 (0.50) ABCG2
SCHEMBL22201406 0.80 ABCG2 (0.55) ABCG2
SCHEMBL22201457 0.78 ALDH1A1 (0.59) ABCG2
SCHEMBL22201422 0.76 ABCG2 (0.60) ABCG2
SCHEMBL22201297 0.74 ABCG2 (0.50) ABCG2
SCHEMBL22201398 0.71 ABCG2 (0.84) ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020142748-A1 METHODS AND MATERIALS FOR INCREASING TRANSCRIPTION FACTOR EB POLYPEPTIDE LEVELS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-07-09 WO disclosed