SCHEMBL20056934

SCHEMBL20056934

C=CC1=C(N=C)C(=C)N(c2cnn(CC(F)(F)F)c2)C1=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 5/20 0.32
▸ PRKDC P78527 1/20 0.30

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
SCHEMBL610864 0.69 SMN1; SMN2 (0.39) PIK3CGPRKDC
SCHEMBL612940 0.62 SMN1; SMN2 (0.50) —
SCHEMBL24908210 0.62 LRRK2 (0.33) —
SCHEMBL23564729 0.59 HTT (0.46) PIK3CGPRKDC
SCHEMBL3319742 0.59 HDAC2 (0.36) —
SCHEMBL2148413 0.58 L3MBTL1 (0.57) —
SCHEMBL18948352 0.56 PIK3CG (0.54) PIK3CGPRKDC
SCHEMBL11918297 0.56 PIK3CG (0.40) PIK3CGPRKDC
SCHEMBL15462088 0.56 PIK3CG (0.51) PIK3CGPRKDC
SCHEMBL13275224 0.56 LRRK2 (0.33) PIK3CGPRKDC

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3808739-A1 ISOINDOLINONE INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE Vertex Pharmaceuticals Incorporated (US) 2021-04-21 — — EP disclosed
EP-3309152-B1 ISOINDOLINONE INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE VERTEX PHARMA (US) 2020-09-09 — — EP disclosed
EP-3309152-A1 ISOINDOLINONE INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE Vertex Pharmaceuticals Incorporated (US) 2018-04-18 — — EP disclosed
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