SCHEMBL22201691

SCHEMBL22201691

Cc1cccc2c(Nc3ccc4cnsc4c3)nc(-c3ccncc3)nc12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 3/20 0.47
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 3/20 0.46
RXFP1 Q9HBX9 1/20 0.46
HPGD P15428 3/20 0.44
LMNA P02545 2/20 0.44
POLB P06746 2/20 0.44
GSK3A P49840 1/20 0.44
GSK3B P49841 1/20 0.44
ABCG2 Q9UNQ0 11/20 0.44
ABCB1 P08183 3/20 0.44
MAPT P10636 1/20 0.43
PDE5A O76074 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.41
ABCC1 P33527 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL22201672 0.83 HPGD (0.64) LATS1ALDH1A1KDM4ERXFP1HPGD
SCHEMBL22201694 0.82 KDM4E (0.56) LATS1ALDH1A1KDM4ERXFP1HPGD
SCHEMBL22201426 0.81 ABCG2 (0.54) ABCG2
SCHEMBL22201614 0.81 TGFBR1 (0.56) LATS1ALDH1A1KDM4ERXFP1HPGD
SCHEMBL22201419 0.80 LATS1 (0.52) LATS1ALDH1A1KDM4ERXFP1HPGD
SCHEMBL22201692 0.77 KDM4E (0.44) LATS1ALDH1A1KDM4ERXFP1HPGD
SCHEMBL22201695 0.76 ALDH1A1 (0.49) LATS1ALDH1A1KDM4ERXFP1HPGD
SCHEMBL22201358 0.76 TGFBR1 (0.53) LATS1ALDH1A1KDM4ERXFP1HPGD
SCHEMBL22201693 0.72 KDM4E (0.54) LATS1ALDH1A1KDM4ERXFP1HPGD
SCHEMBL14474452 0.71 MAPT (0.53) ALDH1A1KDM4EHPGDLMNAABCG2

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