SCHEMBL22201550

SCHEMBL22201550

Cc1c(Nc2nc(-c3ccncc3)nc3ccccc23)ccc2[nH]ccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.58
KDM4E B2RXH2 4/20 0.58
ALDH1A1 P00352 3/20 0.57
LMNA P02545 3/20 0.57
RXFP1 Q9HBX9 1/20 0.57
HPGD P15428 3/20 0.56
PDE5A O76074 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
GSK3B P49841 2/20 0.54
AURKA O14965 1/20 0.54
SRC P12931 1/20 0.54
TGFBR1 P36897 1/20 0.53
MAPK14 Q16539 1/20 0.53
LATS1 O95835 1/20 0.52
ABCG2 Q9UNQ0 7/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ABCC1 P33527 1/20 0.51
ABCB1 P08183 3/20 0.49
GSK3A P49840 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
SCHEMBL22201308 0.89 LATS1 (0.49) POLBKDM4EALDH1A1LMNARXFP1
SCHEMBL22201545 0.85 KDM4E (0.72) POLBKDM4EALDH1A1LMNARXFP1
SCHEMBL22201418 0.85 ABCG2 (0.47) POLBKDM4ELATS1ABCG2
SCHEMBL1059917 0.78 ABCG2 (0.60) KDM4EALDH1A1LMNAPDE5AGSK3B
SCHEMBL22201341 0.78 PRKD1 (0.66) POLBKDM4EALDH1A1LMNARXFP1
SCHEMBL22201541 0.76 KDM4E (0.72) POLBKDM4EALDH1A1LMNARXFP1
SCHEMBL22201679 0.76 LMNA (0.59) POLBKDM4EALDH1A1LMNARXFP1
SCHEMBL22201678 0.76 HPGD (0.65) POLBKDM4EALDH1A1LMNARXFP1
SCHEMBL22201428 0.75 ALDH1A1 (0.81) POLBKDM4EALDH1A1LMNARXFP1
SCHEMBL7434986 0.73 ALDH1A1 (1.00) POLBKDM4EALDH1A1LMNARXFP1

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