SCHEMBL22201579

SCHEMBL22201579

Cc1cccc(Nc2nc(-c3ccncc3)nc3ccccc23)c1

nearest known ligand 0.85

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 10/20 0.85
ABCB1 P08183 3/20 0.85
SMN1; SMN2 Q16637 2/20 0.85
MAPT P10636 2/20 0.85
LATS1 O95835 1/20 0.80
ALDH1A1 P00352 3/20 0.76
KDM4E B2RXH2 3/20 0.76
POLB P06746 3/20 0.76
HPGD P15428 3/20 0.76
LMNA P02545 2/20 0.76
PDE5A O76074 1/20 0.76
GSK3A P49840 1/20 0.76
GSK3B P49841 1/20 0.76
RXFP1 Q9HBX9 1/20 0.75
TGFBR1 P36897 1/20 0.67
MAPK14 Q16539 1/20 0.67
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67

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
SCHEMBL22201428 0.91 ALDH1A1 (0.81) ABCG2ABCB1SMN1; SMN2MAPTLATS1
SCHEMBL26177129 0.89 LATS1 (1.00) ABCG2ABCB1SMN1; SMN2MAPTLATS1
SCHEMBL7434986 0.87 ALDH1A1 (1.00) ABCG2ABCB1SMN1; SMN2MAPTLATS1
SCHEMBL8096433 0.86 ABCG2 (0.83) ABCG2ABCB1SMN1; SMN2MAPTLATS1
SCHEMBL1083761 0.86 HPGD (1.00) ABCG2ABCB1SMN1; SMN2MAPTALDH1A1
SCHEMBL1083796 0.86 KDM4E (1.00) ABCG2ABCB1SMN1; SMN2MAPTLATS1
SCHEMBL22201344 0.85 ALDH1A1 (0.72) ABCG2ABCB1SMN1; SMN2MAPTLATS1
SCHEMBL1083768 0.85 KDM4E (1.00) ABCG2ABCB1SMN1; SMN2MAPTALDH1A1
SCHEMBL22201361 0.84 ABCG2 (1.00) ABCG2ABCB1SMN1; SMN2MAPTALDH1A1
SCHEMBL22201663 0.84 ALDH1A1 (0.70) ABCG2ABCB1SMN1; SMN2MAPTLATS1

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