Acalisib

Acalisib

SCHEMBL356540

CC(Nc1ncnc2[nH]cnc12)c1nc2ccc(F)cc2c(=O)n1-c1ccccc1

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PIK3CD

The experimentally established mechanism targets of Acalisib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD known ✓ O00329 16/20 0.77
PIK3CG P48736 8/20 0.77
PIK3C3 Q8NEB9 1/20 0.77
PIK3CB P42338 10/20 0.60
PIK3R1 P27986 8/20 0.58
PIK3CA P42336 6/20 0.58

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
Acalisib SCHEMBL29422834 1.00 PIK3CD (0.77) PIK3CDPIK3CGPIK3C3PIK3CBPIK3R1
Acalisib SCHEMBL16677409 1.00 PIK3CD (0.77) PIK3CDPIK3CGPIK3C3PIK3CBPIK3R1
Acalisib SCHEMBL29360030 1.00 PIK3CD (0.77) PIK3CDPIK3CGPIK3C3PIK3CBPIK3R1
Acalisib SCHEMBL356539 1.00 PIK3CD (0.77) PIK3CDPIK3CGPIK3C3PIK3CBPIK3R1
SCHEMBL16677731 0.95 PIK3CD (0.70) PIK3CDPIK3CGPIK3C3PIK3CBPIK3R1
SCHEMBL16677771 0.95 PIK3CD (0.70) PIK3CDPIK3CGPIK3C3PIK3CBPIK3R1
SCHEMBL16677429 0.95 PIK3CD (0.70) PIK3CDPIK3CGPIK3C3PIK3CBPIK3R1
SCHEMBL356432 0.95 PIK3CD (0.69) PIK3CDPIK3CGPIK3C3PIK3CBPIK3R1
SCHEMBL16677730 0.95 PIK3CD (0.69) PIK3CDPIK3CGPIK3C3PIK3CBPIK3R1
SCHEMBL16677435 0.95 PIK3CD (0.69) PIK3CDPIK3CGPIK3C3PIK3CBPIK3R1

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 326 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037342-B2 Substituted eneoxindoles and uses thereof GILEAD SCIENCES, INC. (US) 2024-07-16 US claimed
US-20240025923-A1 BIFUNCTIONAL DEGRADERS OF HEMATOPOIETIC PROGENITOR KINASE AND THERAPEUTIC USES THEREOF NURIX THERAPEUTICS INC (US) 2024-01-25 US claimed
US-20230183262-A1 SUBSTITUTED ENEOXINDOLES AND USES THEREOF GILEAD SCIENCES, INC. 2023-06-15 US claimed
WO-2023086399-A1 BIFUNCTIONAL DEGRADERS OF HEMATOPOIETIC PROGENITOR KINASE AND THERAPEUTIC USES THEREOF NURIX THERAPEUTICS, INC. (US) 2023-05-19 WO claimed
EP-4146660-A1 BIFUNCTIONAL DEGRADERS OF HEMATOPOIETIC PROGENITOR KINASE AND THERAPEUTIC USES THEREOF Nurix Therapeutics, Inc. (US) 2023-03-15 EP claimed
US-20220241281-A1 Imidazopyrimidine Derivatives GILEAD SCIENCES, INC. 2022-08-04 US claimed
WO-2021226262-A1 BIFUNCTIONAL DEGRADERS OF HEMATOPOIETIC PROGENITOR KINASE AND THERAPEUTIC USES THEREOF NURIX THERAPEUTICS, INC. (US) 2021-11-11 WO claimed
EP-3873903-A1 SUBSTITUTED 6-AZABENZIMIDAZOLE COMPOUNDS AS HPK1 INHIBITORS GILEAD SCIENCES, INC. (US) 2021-09-08 EP claimed
EP-3873608-A1 SUBSTITUTED 6-AZABENZIMIDAZOLE COMPOUNDS HAVING HPK1 INHIBITORY ACTIVITY GILEAD SCIENCES, INC. (US) 2021-09-08 EP claimed
WO-2020237025-A1 SUBSTITUTED EXO-METHYLENE-OXINDOLES WHICH ARE HPK1/MAP4K1 INHIBITORS GILEAD SCIENCES, INC. (US) 2020-11-26 WO claimed
US-20060106038-A1 Methods for treating and/or preventing aberrant proliferation of hematopoietic cells ICOS CORPORATION (US) 2006-05-18 US claimed
US-20060079538-A1 Methods for inhibiting angiogenesis VANDERBILT UNIVERSITY 2006-04-13 US claimed
WO-2005120511-A1 METHODS FOR TREATING MAST CELL DISORDERS ICOS CORPORATION (US) 2005-12-22 WO claimed
WO-2005117889-A1 METHODS FOR TREATING AND/OR PREVENTING ABERRANT PROLIFERATION OF HEMATOPOIETIC ICOS CORPORATION (US) 2005-12-15 WO claimed
WO-2005112935-A1 PHOSPHOINOSITIDE 3-KINASE DELTA SELECTIVE INHIBITORS FOR INHIBITING ANGIOGENESIS VANDERBILT UNIVERSITY (US) 2005-12-01 WO claimed
WO-2005113556-A1 QUINAZOLINONES AS INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2005-12-01 WO claimed
US-20050054614-A1 Methods of inhibiting leukocyte accumulation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-03-10 US claimed
US-20050043239-A1 Methods of inhibiting immune responses stimulated by an endogenous factor ICOS CORPORATION 2005-02-24 US claimed
WO-2005016349-A1 METHODS OF INHIBITING LEUKOCYTE ACCUMULATION ICOS CORPORATION (US) 2005-02-24 WO claimed
WO-2005016348-A1 METHOD OF INHIBITING IMMUNE RESPONSES STIMULATED BY AN ENDOGENOUS FACTOR ICOS CORPORATION (US) 2005-02-24 WO claimed

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

For each of this compound's patents that has machine-readable text (8 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-20050054614-A1 Methods of inhibiting leukocyte accumulation PI4KB, PIK3CD, PIK3CA PIK3CD 2/4885PIK3CG 7/4885PIK3C3 11/4885
US-20220241281-A1 Imidazopyrimidine Derivatives DPYD, KRAS, ABL1 PIK3CD 154/4885PIK3CG 433/4885PIK3C3 905/4885
US-20060079538-A1 Methods for inhibiting angiogenesis FLT4, KDR, PDGFRB PIK3CD 6/4885PIK3CG 13/4885PIK3C3 45/4885
US-20050043239-A1 Methods of inhibiting immune responses stimulated by an endogenous factor PI4KB, PI4KA, PIK3CD PIK3CD 3/4885PIK3CG 10/4885PIK3C3 19/4885
US-20060106038-A1 Methods for treating and/or preventing aberrant proliferation of hematopoietic cells MCL1, NFATC1, MKI67 PIK3CD 25/4885PIK3CG 57/4885PIK3C3 122/4885
US-20230183262-A1 SUBSTITUTED ENEOXINDOLES AND USES THEREOF HIPK1, HPGDS, HIPK3 PIK3CD 2727/4885PIK3CG 3429/4885PIK3C3 2250/4885
US-12037342-B2 Substituted eneoxindoles and uses thereof HIPK1, HPGDS, HIPK3 PIK3CD 2727/4885PIK3CG 3429/4885PIK3C3 2250/4885
US-20240025923-A1 BIFUNCTIONAL DEGRADERS OF HEMATOPOIETIC PROGENITOR KINASE AND THERAPEUTIC USES THEREOF TTK, HIPK1, HIPK2 PIK3CD 2395/4885PIK3CG 2700/4885PIK3C3 1607/4885

“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.