SCHEMBL14335160

SCHEMBL14335160

NC(=O)c1cccnc1O[C@@H]1CCN(C(=O)C2CCOCC2)C1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 9/20 0.47
▸ PIK3CA P42336 7/20 0.47
▸ PIK3R1 P27986 1/20 0.46

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
SCHEMBL14335162 0.87 PIK3CD (0.50) PIK3CDPIK3CAPIK3R1
SCHEMBL14334926 0.80 ROCK2 (0.46) —
SCHEMBL14334913 0.80 ROCK2 (0.48) —
SCHEMBL14334120 0.78 ROCK2 (0.48) —
SCHEMBL3673425 0.77 GRM4 (0.50) —
SCHEMBL14334239 0.76 ROCK2 (0.50) —
SCHEMBL3675210 0.73 ROCK2 (0.47) —
SCHEMBL31234741 0.72 NAMPT (0.44) PIK3CDPIK3CA
SCHEMBL23458839 0.72 ROCK2 (0.53) —
SCHEMBL20646781 0.71 RAB9A (0.48) —

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-2012176123-A1 3 - IMIDAZOLYL- INDOLES FOR THE TREATMENT OF PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2012-12-27 — — WO disclosed
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