SCHEMBL22201341

SCHEMBL22201341

c1ccc2c(Nc3ccc4[nH]ccc4c3)nc(-c3ccncc3)nc2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD1 Q15139 1/20 0.66
TGFBR1 P36897 2/20 0.66
HPGD P15428 3/20 0.65
ALDH1A1 P00352 3/20 0.65
KDM4E B2RXH2 3/20 0.65
POLB P06746 2/20 0.65
PDE5A O76074 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
LMNA P02545 2/20 0.65
MAPT P10636 1/20 0.65
KDM1A O60341 1/20 0.64
GSK3A P49840 1/20 0.63
GSK3B P49841 1/20 0.63
ABCG2 Q9UNQ0 10/20 0.62
RXFP1 Q9HBX9 1/20 0.62
MAPK14 Q16539 1/20 0.62
ABCB1 P08183 3/20 0.61
MEN1 O00255 1/20 0.58
ABCC1 P33527 1/20 0.58
KMT2A Q03164 1/20 0.58

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
SCHEMBL1062778 0.93 TGFBR1 (0.71) PRKD1TGFBR1PDE5ASMN1; SMN2LMNA
SCHEMBL22201678 0.91 HPGD (0.65) TGFBR1HPGDALDH1A1KDM4EPOLB
SCHEMBL22201395 0.89 FGFR2 (0.55) PRKD1TGFBR1HPGDALDH1A1KDM4E
SCHEMBL22201553 0.88 KDM1A (0.66) PRKD1TGFBR1POLBPDE5ASMN1; SMN2
SCHEMBL22201354 0.87 HPGD (0.55) PRKD1TGFBR1HPGDALDH1A1KDM4E
SCHEMBL22201356 0.87 HPGD (0.55) PRKD1TGFBR1HPGDALDH1A1KDM4E
SCHEMBL22201348 0.86 PRKD1 (0.60) PRKD1TGFBR1HPGDALDH1A1KDM4E
SCHEMBL22201387 0.85 TGFBR1 (0.64) PRKD1TGFBR1PDE5ASMN1; SMN2MAPT
SCHEMBL22201394 0.85 FGFR2 (0.54) PRKD1TGFBR1HPGDALDH1A1KDM4E
SCHEMBL22201397 0.84 ABCG2 (0.55) PRKD1ABCG2

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