SCHEMBL20766014

SCHEMBL20766014

CC(C)(C)OC(=O)N1CCC(NCc2ccc(F)cc2)C(F)C1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNMT3A Q9Y6K1 1/20 0.46
TP53 P04637 1/20 0.46
GPR119 Q8TDV5 4/20 0.46
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
USP30 Q70CQ3 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 1/20 0.43
BRD3 Q15059 1/20 0.43
MMP13 P45452 1/20 0.43
CYP2D6 P10635 1/20 0.42
CCR3 P51677 1/20 0.42
TACR1 P25103 1/20 0.42

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
SCHEMBL29673246 1.00 DNMT3A (0.46) DNMT3ATP53GPR119HDAC1HDAC2
SCHEMBL20778648 1.00 DNMT3A (0.46) DNMT3ATP53GPR119HDAC1HDAC2
SCHEMBL20794795 1.00 DNMT3A (0.46) DNMT3ATP53GPR119HDAC1HDAC2
SCHEMBL29673228 1.00 DNMT3A (0.46) DNMT3ATP53GPR119HDAC1HDAC2
SCHEMBL29673216 1.00 DNMT3A (0.46) DNMT3ATP53GPR119HDAC1HDAC2
SCHEMBL517515 0.90 USP30 (0.53) TP53GPR119USP30TACR1
SCHEMBL5768083 0.90 USP30 (0.53) TP53GPR119USP30TACR1
SCHEMBL2292408 0.90 USP30 (0.53) TP53GPR119USP30TACR1
SCHEMBL2273817 0.90 USP30 (0.53) TP53GPR119USP30TACR1
SCHEMBL2292403 0.90 USP30 (0.53) TP53GPR119USP30TACR1

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-2019040106-A2 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA PHARMACEUTICALS INC. (US) 2019-02-28 WO disclosed