SCHEMBL22201692

SCHEMBL22201692

Cc1cccc2c(Nc3ccc4nc(C5CC5)sc4c3)nc(-c3ccncc3)nc12

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 3/20 0.44
RXFP1 Q9HBX9 1/20 0.44
LATS1 O95835 2/20 0.43
HPGD P15428 3/20 0.42
LMNA P02545 2/20 0.42
POLB P06746 2/20 0.42
GSK3A P49840 1/20 0.42
GSK3B P49841 1/20 0.42
ABCG2 Q9UNQ0 10/20 0.42
ABCB1 P08183 3/20 0.42
MAPT P10636 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PDE5A O76074 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ABCC1 P33527 1/20 0.40

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
SCHEMBL22201617 0.89 LMNA (0.48) KDM4EALDH1A1RXFP1LATS1HPGD
SCHEMBL22201694 0.87 KDM4E (0.56) KDM4EALDH1A1RXFP1LATS1HPGD
SCHEMBL22201559 0.86 HPGD (0.58) KDM4EALDH1A1RXFP1HPGDLMNA
SCHEMBL22201258 0.83 ABCG2 (0.48) HPGDLMNAABCG2MAPT
SCHEMBL22201432 0.82 LATS1 (0.47) KDM4EALDH1A1RXFP1LATS1HPGD
SCHEMBL22201566 0.81 KDM4E (0.40) KDM4EALDH1A1RXFP1ABCG2ABCB1
SCHEMBL22201614 0.80 TGFBR1 (0.56) KDM4EALDH1A1RXFP1LATS1HPGD
SCHEMBL22201693 0.77 KDM4E (0.54) KDM4EALDH1A1RXFP1LATS1HPGD
SCHEMBL22201691 0.77 LATS1 (0.47) KDM4EALDH1A1RXFP1LATS1HPGD
SCHEMBL22201586 0.77 PRKCH (0.47) KDM4EALDH1A1HPGDLMNAPOLB

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