SCHEMBL20009346

SCHEMBL20009346

O=C(O)c1cc(N2CCOCC2)cc2c1ncn2-c1cccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3C2B O00750 10/20 0.58
PIK3R2 O00459 9/20 0.49
PKM P14618 1/20 0.48
PIK3CD O00329 2/20 0.45
PIK3R1 P27986 2/20 0.45
PIK3CB P42338 2/20 0.45
PIK3CA P42336 1/20 0.45
PIK3CG P48736 1/20 0.45

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
SCHEMBL20009344 0.89 PIK3C2B (0.49) PIK3C2BPIK3R2PIK3CDPIK3R1PIK3CB
SCHEMBL19991579 0.88 PIK3R2 (0.52) PIK3C2BPIK3R2PKMPIK3CDPIK3R1
SCHEMBL19989246 0.84 PIK3R2 (0.65) PIK3R2PIK3CDPIK3R1PIK3CBPIK3CA
SCHEMBL19989364 0.84 PIK3R2 (0.71) PIK3R2PIK3CDPIK3R1PIK3CBPIK3CA
SCHEMBL20009347 0.81 PIK3C2B (0.70) PIK3C2BPIK3R2PIK3CDPIK3R1PIK3CB
SCHEMBL19989037 0.80 PIK3R2 (0.68) PIK3C2BPIK3R2PIK3CDPIK3R1PIK3CB
SCHEMBL19991567 0.80 PIK3R2 (0.51) PIK3C2BPIK3R2PIK3CDPIK3R1PIK3CB
SCHEMBL19989491 0.78 PIK3R2 (0.65) PIK3R2
SCHEMBL19991587 0.78 PIK3R2 (0.51) PIK3R2PIK3CDPIK3R1PIK3CBPIK3CA
SCHEMBL19989351 0.78 PIK3R2 (0.66) PIK3C2BPIK3R2PIK3CDPIK3R1PIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10479770-B2 Phosphatidylinositol 3-kinase inhibitors GILEAD SCIENCES, INC. (US) 2019-11-19 US disclosed
US-20180086719-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. 2018-03-29 US disclosed
US-20180086719-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. 2018-03-29 US disclosed
WO-2018057805-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. (US) 2018-03-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180086719-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PIK3CA, AKT3, PI4KA PIK3C2B 15/4885PIK3R2 30/4885PKM 529/4885
US-10479770-B2 Phosphatidylinositol 3-kinase inhibitors PIK3CA, AKT3, PI4KA PIK3C2B 15/4885PIK3R2 30/4885PKM 529/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.