SCHEMBL22201353

SCHEMBL22201353

COc1cccc2nc(-c3ccncc3)nc(Nc3ccc4[nH]ccc4c3)c12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 11/20 0.54
ABCB1 P08183 7/20 0.54
TGFBR1 P36897 1/20 0.48
PRKD1 Q15139 1/20 0.47
FGFR2 P21802 1/20 0.47
FLT3 P36888 1/20 0.47
ABCC1 P33527 4/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
KDM1A O60341 1/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
HPGD P15428 1/20 0.45
GSK3A P49840 1/20 0.45
GSK3B P49841 1/20 0.45
TLR8 Q9NR97 1/20 0.45
TLR7 Q9NYK1 1/20 0.45
NAE1 Q13564 1/20 0.43
EGFR P00533 1/20 0.43

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
SCHEMBL22201355 0.85 LMNA (0.52) ABCG2ABCB1TGFBR1PRKD1FGFR2
SCHEMBL22201351 0.84 ABCG2 (0.54) ABCG2ABCB1TGFBR1PRKD1FGFR2
SCHEMBL22201341 0.80 PRKD1 (0.66) ABCG2ABCB1TGFBR1PRKD1ABCC1
SCHEMBL22201394 0.79 FGFR2 (0.54) ABCG2ABCB1TGFBR1PRKD1FGFR2
SCHEMBL22201347 0.79 ABCG2 (0.58) ABCG2ABCB1TGFBR1PRKD1FGFR2
SCHEMBL22201350 0.79 ABCG2 (0.58) ABCG2ABCB1TGFBR1PRKD1FGFR2
SCHEMBL22201356 0.76 HPGD (0.55) ABCG2ABCB1TGFBR1PRKD1FGFR2
SCHEMBL22201354 0.76 HPGD (0.55) ABCG2ABCB1TGFBR1PRKD1FGFR2
SCHEMBL22201395 0.76 FGFR2 (0.55) ABCG2ABCB1TGFBR1PRKD1FGFR2
SCHEMBL22201348 0.76 PRKD1 (0.60) ABCG2ABCB1TGFBR1PRKD1FGFR2

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