SCHEMBL22201484

SCHEMBL22201484

Fc1cccc(Nc2nc(-c3ccncn3)nc3ccccc23)c1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.71
LMNA P02545 2/20 0.71
ALDH1A1 P00352 2/20 0.71
POLB P06746 2/20 0.71
GSK3A P49840 1/20 0.71
GSK3B P49841 1/20 0.71
ABCG2 Q9UNQ0 13/20 0.66
EGFR P00533 1/20 0.58
ABCB1 P08183 1/20 0.55
KDM4E B2RXH2 2/20 0.54
MAPT P10636 1/20 0.54
TGFBR1 P36897 2/20 0.54
PDE5A O76074 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MAPK14 Q16539 1/20 0.52

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
SCHEMBL14727474 0.84 ABCG2 (0.69) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL14727478 0.84 ABCG2 (0.59) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL1083761 0.83 HPGD (1.00) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL22201289 0.80 ABCG2 (0.79) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL1083806 0.77 MEN1 (0.71) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL1064930 0.76 TGFBR1 (0.78) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL22201628 0.75 ABCG2 (0.83) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL22201264 0.74 ABCG2 (0.71) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL668559 0.74 EGFR (1.00) ABCG2EGFRMAPK14
SCHEMBL12258624 0.74 CSNK2A1 (0.73) HPGDLMNAALDH1A1POLBGSK3A

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