SCHEMBL20375264

SCHEMBL20375264

Cc1ncnc2[nH]nc(I)c12

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
PRKDC P78527 1/20 0.33
CHEK1 O14757 1/20 0.32
YTHDC1 Q96MU7 1/20 0.31
YTHDF2 Q9Y5A9 1/20 0.31

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
SCHEMBL12647317 0.81 YTHDC1 (0.33) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL8801 0.78 PIK3CD (0.42) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL13717500 0.77 PDPK1 (0.44) CHEK1YTHDC1YTHDF2
SCHEMBL311873 0.76 CHEK1 (0.52) CHEK1
SCHEMBL21620529 0.76 CHEK1 (0.35) CHEK1YTHDC1YTHDF2
SCHEMBL4565125 0.76 CHEK1 (0.32) CHEK1
SCHEMBL15473878 0.76 YTHDC1 (0.31) YTHDC1YTHDF2
SCHEMBL13717667 0.76 CHEK1 (0.46) CHEK1
SCHEMBL7247749 0.76 ALDH1A1 (0.38)
SCHEMBL12540861 0.76 CYP1A2 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3345907-B1 PYRAZOLO[3,4-D]PYRIMIDINE COMPOUNDS OR SALTS THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2020-04-22 EP disclosed
EP-3345907-A1 NOVEL PYRAZOLO[3,4-d]PYRIMIDINE COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2018-07-11 EP disclosed