SCHEMBL22201613

SCHEMBL22201613

CCc1nc2ccc(Nc3nc(-c4ccncc4)nc4cccc(F)c34)cc2s1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
HPGD P15428 3/20 0.48
MAPT P10636 1/20 0.48
ALDH1A1 P00352 3/20 0.46
POLB P06746 2/20 0.46
GSK3A P49840 1/20 0.46
GSK3B P49841 1/20 0.46
ABCG2 Q9UNQ0 11/20 0.43
ABCB1 P08183 4/20 0.41
KDM4E B2RXH2 4/20 0.41
RXFP1 Q9HBX9 1/20 0.41
LATS1 O95835 1/20 0.40
PDE5A O76074 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL22201459 0.87 ABCG2 (0.51) LMNAHPGDMAPTALDH1A1POLB
SCHEMBL22201611 0.86 LMNA (0.49) LMNAHPGDMAPTALDH1A1POLB
SCHEMBL22201558 0.84 ALDH1A1 (0.59) LMNAHPGDMAPTALDH1A1POLB
SCHEMBL22201465 0.83 HPGD (0.50) LMNAHPGDMAPTALDH1A1POLB
SCHEMBL22201359 0.81 LATS1 (0.48) LMNAHPGDMAPTALDH1A1POLB
SCHEMBL22201688 0.80 KDM4E (0.53) LMNAHPGDMAPTALDH1A1POLB
SCHEMBL22201297 0.78 ABCG2 (0.50) ABCG2
SCHEMBL22201456 0.77 ABCG2 (0.52) LMNAHPGDMAPTALDH1A1POLB
SCHEMBL22201687 0.77 ABCG2 (0.54) LMNAHPGDMAPTABCG2ABCB1
SCHEMBL22201355 0.73 LMNA (0.52) LMNAHPGDMAPTALDH1A1POLB

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