SCHEMBL22201264

SCHEMBL22201264

Fc1cccc(Nc2nc(-c3cncs3)nc3ccccc23)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 15/20 0.71
ALDH1A1 P00352 2/20 0.64
LMNA P02545 2/20 0.64
HPGD P15428 2/20 0.64
POLB P06746 1/20 0.64
GSK3A P49840 1/20 0.64
GSK3B P49841 1/20 0.64
CD38 P28907 1/20 0.57
PDE5A O76074 2/20 0.54
EGFR P00533 1/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
MAPT P10636 3/20 0.52
KDM4E B2RXH2 1/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ABCB1 P08183 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
TP53 P04637 1/20 0.49

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
SCHEMBL22201247 0.81 GRM4 (0.50) ABCG2ALDH1A1LMNAHPGDPOLB
SCHEMBL22201412 0.81 TGFBR1 (0.65) ABCG2ALDH1A1LMNAHPGDCD38
SCHEMBL22201407 0.80 TGFBR1 (0.60) ABCG2ALDH1A1LMNAHPGDCD38
SCHEMBL22201301 0.80 PDE5A (0.47) ABCG2ALDH1A1LMNAHPGDPDE5A
SCHEMBL22201253 0.80 PDE5A (0.47) ABCG2ALDH1A1LMNAHPGDPDE5A
SCHEMBL22201291 0.80 TGFBR1 (0.48) ABCG2ALDH1A1LMNAHPGDPDE5A
SCHEMBL22201289 0.80 ABCG2 (0.79) ABCG2ALDH1A1LMNAHPGDPOLB
SCHEMBL22201263 0.79 TGFBR1 (0.61) ABCG2ALDH1A1LMNAHPGDPDE5A
SCHEMBL22201274 0.79 TGFBR1 (0.63) ABCG2PDE5AEGFR
SCHEMBL22201300 0.79 TGFBR1 (0.52) ABCG2ALDH1A1LMNAHPGDPDE5A

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