SCHEMBL22201468

SCHEMBL22201468

COc1ccc(-c2nc(Nc3ccc(C)c(F)c3)c3ccccc3n2)cc1

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 15/20 0.71
▸ ABCB1 P08183 6/20 0.71
▸ ABCC1 P33527 4/20 0.71
▸ MEN1 O00255 3/20 0.69
▸ KMT2A Q03164 3/20 0.69
▸ KDM1A O60341 1/20 0.65
▸ PDE5A O76074 1/20 0.62
▸ SYK P43405 1/20 0.60
▸ LMNA P02545 1/20 0.59
▸ MAPT P10636 1/20 0.59
▸ HPGD P15428 1/20 0.59

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
SCHEMBL16404494 0.86 ABCG2 (0.95) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL1064726 0.84 ABCG2 (1.00) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL6001931 0.83 ABCG2 (0.93) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL16404295 0.83 ABCG2 (1.00) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL16404472 0.82 ABCG2 (0.87) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL6001975 0.80 ABCG2 (0.88) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL1063510 0.79 ABCG2 (0.91) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL1083764 0.79 ABCG2 (1.00) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL16404481 0.79 ABCG2 (0.80) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL2294947 0.79 ABCG2 (0.76) ABCG2ABCB1ABCC1MEN1KMT2A

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
Send feedback