SCHEMBL23912265

SCHEMBL23912265

CCc1nc2cccc(CCCN3CCOCC3)c2c(=O)n1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 13/20 0.56
KCNH2 Q12809 2/20 0.49
HRH3 Q9Y5N1 2/20 0.49
GAA P10253 1/20 0.46
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
HTR7 P34969 1/20 0.42

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
SCHEMBL23912237 0.91 HRH3 (0.59) PIK3CDKCNH2HRH3
SCHEMBL23912317 0.88 PIK3CD (0.58) PIK3CDKCNH2HRH3ALDH1A1SMN1; SMN2
SCHEMBL23912303 0.86 PIK3CD (0.57) PIK3CDKCNH2HRH3ALDH1A1SMN1; SMN2
SCHEMBL23912243 0.84 PIK3CD (0.50) PIK3CDKCNH2HRH3ALDH1A1SMN1; SMN2
SCHEMBL23912306 0.82 PIK3CD (0.56) PIK3CDKCNH2HRH3GAAALDH1A1
SCHEMBL23912240 0.77 PIK3CD (0.55) PIK3CDKCNH2HRH3GAAALDH1A1
SCHEMBL23912253 0.77 SMN1; SMN2 (0.45) PIK3CDKCNH2HRH3ALDH1A1SMN1; SMN2
SCHEMBL20404284 0.76 SMN1; SMN2 (0.48) PIK3CDKCNH2HRH3ALDH1A1SMN1; SMN2
SCHEMBL19924360 0.75 PIK3CD (0.67) PIK3CDKCNH2HRH3
SCHEMBL17458267 0.75 PIK3CD (0.67) PIK3CDKCNH2HRH3

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
EP-3160960-B1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES INC (US) 2021-10-13 EP disclosed