SCHEMBL27604297

SCHEMBL27604297

Nc1ncnc2c1c(-c1ccc(NC=O)c(F)c1)nn2C1CCNCC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 18/20 0.61
▸ PIK3CD O00329 17/20 0.61
▸ PIK3CA P42336 17/20 0.61
▸ PIK3CB P42338 17/20 0.61
▸ PIK3CG P48736 17/20 0.61
▸ PRKDC P78527 17/20 0.61
▸ ABL1 P00519 16/20 0.61
▸ EGFR P00533 16/20 0.61
▸ HCK P08631 16/20 0.61
▸ KDR P35968 16/20 0.61
▸ MTOR P42345 16/20 0.61
▸ EPHB4 P54760 15/20 0.61
▸ PI4KB Q9UBF8 12/20 0.61
▸ LCK P06239 1/20 0.57

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
SCHEMBL5804210 0.85 SRC (0.69) SRCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24096567 0.81 SRC (0.61) SRCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6434464 0.79 LCK (0.56) SRCPIK3CDPIK3CAPIK3CBPIK3CG
Hydrochloric Acid SCHEMBL6431342 0.79 LCK (0.56) SRCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24196618 0.78 BTK (0.63) SRCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL30416266 0.78 BTK (0.63) SRCPIK3CDPIK3CAPIK3CBPIK3CG
Hydrochloric Acid SCHEMBL27586575 0.77 LCK (0.53) SRCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24096758 0.77 PIK3CD (0.69) SRCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL29998830 0.77 PIK3CD (0.69) SRCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL23997162 0.77 EGFR (0.61) SRCPIK3CDPIK3CAPIK3CBPIK3CG

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
CN-1520298-A Pyrazolopyrimidines as therapeutic agents �����ʩ���عɷݹ�˾ 2004-08-11 — — CN disclosed
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