SCHEMBL18076641

SCHEMBL18076641

O=C(O)NCCc1nc2cccc(F)c2c(=O)n1C1CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 9/20 0.39
HRH3 Q9Y5N1 1/20 0.38
JAK1 P23458 1/20 0.38
POLB P06746 2/20 0.37
TP53 P04637 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
PIK3CG P48736 1/20 0.36
MAPT P10636 1/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL16584901 0.94 ALDH1A1 (0.39) PIK3CDHRH3POLB
SCHEMBL18076637 0.88 PIK3CD (0.42) PIK3CDHRH3JAK1POLBTP53
SCHEMBL16584926 0.87 PIK3CD (0.40) PIK3CDHRH3POLBTP53PIK3CG
SCHEMBL21178476 0.84 POLB (0.38) PIK3CDJAK1POLBTP53PIK3CA
SCHEMBL18076653 0.83 POLB (0.53) POLBTP53MAPTGAA
SCHEMBL21178215 0.83 PIK3CD (0.37) PIK3CDJAK1POLBTP53PIK3CA
SCHEMBL21178453 0.82 PIK3CD (0.45) PIK3CDJAK1POLBTP53PIK3CA
SCHEMBL16584875 0.82 SMN1; SMN2 (0.41) PIK3CDHRH3POLBTP53MAPT
SCHEMBL16597162 0.82 HSP90AB1 (0.49) PIK3CDMAPT
SCHEMBL16584903 0.81 ALDH1A1 (0.39) PIK3CDHRH3PIK3CG

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-2016149160-A1 SUBSTITUTED AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-09-22 WO disclosed