SCHEMBL22201398

SCHEMBL22201398

Fc1cccc(Nc2nc(-c3ccncc3)nc3ncccc23)c1

nearest known ligand 0.84

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 19/20 0.84
ALDH1A1 P00352 1/20 0.70
LMNA P02545 1/20 0.70
POLB P06746 1/20 0.70
HPGD P15428 1/20 0.70
GSK3A P49840 1/20 0.70
GSK3B P49841 1/20 0.70

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
SCHEMBL1083761 0.82 HPGD (1.00) ABCG2ALDH1A1LMNAPOLBHPGD
SCHEMBL22201422 0.82 ABCG2 (0.60) ABCG2LMNAHPGD
SCHEMBL4840411 0.81 ABCG2 (0.86) ABCG2ALDH1A1POLBHPGD
SCHEMBL20299226 0.79 HPGD (0.80) ABCG2ALDH1A1LMNAPOLBHPGD
SCHEMBL20547707 0.79 HPGD (0.80) ABCG2ALDH1A1LMNAPOLBHPGD
SCHEMBL22201397 0.78 ABCG2 (0.55) ABCG2
SCHEMBL22201270 0.78 MEN1 (0.61) ABCG2ALDH1A1LMNAHPGD
SCHEMBL22201393 0.78 ABCG2 (0.55) ABCG2
SCHEMBL22201285 0.78 ABCG2 (0.55) ABCG2
SCHEMBL22201408 0.78 ABCG2 (0.53) ABCG2ALDH1A1LMNAPOLBHPGD

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