SCHEMBL22201430

SCHEMBL22201430

CC(C)c1nc2ccc(Nc3nc(-c4ccncc4)nc4ccncc34)cc2s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 5/20 0.48
ABCG2 Q9UNQ0 7/20 0.46
ABCB1 P08183 2/20 0.46
HPGD P15428 3/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.46
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 3/20 0.46
RXFP1 Q9HBX9 1/20 0.46
POLB P06746 2/20 0.45
PDE5A O76074 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GSK3A P49840 1/20 0.44
GSK3B P49841 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ABCC1 P33527 1/20 0.43
LATS2 Q9NRM7 1/20 0.43
TGFBR1 P36897 1/20 0.42
MAPK14 Q16539 1/20 0.42

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
SCHEMBL22201557 0.90 ALDH1A1 (0.59) ABCG2ABCB1HPGDLMNAMAPT
SCHEMBL22201454 0.89 HPGD (0.51) LATS1ABCG2ABCB1HPGDLMNA
SCHEMBL22201455 0.87 HPGD (0.51) LATS1ABCG2ABCB1HPGDLMNA
SCHEMBL22201357 0.86 KDM4E (0.59) LATS1ABCG2ABCB1HPGDLMNA
SCHEMBL22201463 0.86 ABCG2 (0.55) LATS1ABCG2ABCB1HPGDLMNA
SCHEMBL22201359 0.84 LATS1 (0.48) LATS1ABCG2ABCB1HPGDLMNA
SCHEMBL22201280 0.83 ABCG2 (0.50) ABCG2
SCHEMBL22201453 0.82 LMNA (0.49) LATS1ABCG2ABCB1HPGDLMNA
SCHEMBL22201432 0.81 LATS1 (0.47) LATS1ABCG2ABCB1HPGDLMNA
SCHEMBL22201556 0.80 HPGD (0.62) ABCG2ABCB1HPGDLMNAMAPT

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