SCHEMBL15740604

SCHEMBL15740604

C=CC(=O)Nc1cccc(-c2cnc3[nH]cc(C(=O)C(C)(C)C)c3n2)c1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 5/20 0.64
BTK Q06187 6/20 0.61
ITK Q08881 6/20 0.61
PLCG1 P19174 9/20 0.52

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
SCHEMBL31061214 0.89 BTK (0.60) JAK3BTKITKPLCG1
SCHEMBL15740631 0.89 BTK (0.60) JAK3BTKITKPLCG1
SCHEMBL2271780 0.88 JAK3 (0.65) JAK3BTKITK
SCHEMBL17413158 0.87 BTK (0.61) JAK3BTKITKPLCG1
SCHEMBL2277698 0.85 JAK3 (0.61) JAK3BTKITK
SCHEMBL17412969 0.85 BTK (0.59) JAK3BTKITKPLCG1
SCHEMBL2275429 0.83 JAK3 (0.59) JAK3BTKITK
SCHEMBL2274976 0.83 JAK3 (0.59) JAK3BTKITK
SCHEMBL2280913 0.82 JAK3 (0.59) JAK3BTKITK
SCHEMBL2277104 0.82 JAK3 (0.59) JAK3BTKITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676778-B2 Substituted pyrrolo[2,3-b]pyrazines as JAK3 inhibitors PRINCIPIA BIOPHARMA INC. (US) 2017-06-13 US claimed
EP-2922538-B1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS PRINCIPIA BIOPHARMA INC (US) 2016-10-19 EP claimed
US-20150291600-A1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS PRINCIPIA BIOPHARMA INC. 2015-10-15 US claimed
EP-2922538-A1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS Principia Biopharma Inc. (US) 2015-09-30 EP claimed
WO-2014081732-A1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-05-30 WO claimed
US-11147800-B2 Combinatorial methods to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof RACE ONCOLOGY LTD. (AU) 2021-10-19 US disclosed
US-11135201-B2 Compositions to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof RACE ONCOLOGY LTD. (AU) 2021-10-05 US disclosed
CN-112472699-A Combination methods for improving the therapeutic benefit of bisantrene and derivatives 种族肿瘤学公司 2021-03-12 CN disclosed
US-20200163940-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF RACE ONCOLOGY LTD. (AU) 2020-05-28 US disclosed
US-20200163939-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF SG CREDIT PARTNERS, INC. 2020-05-28 US disclosed
US-10548876-B2 Compositions to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof RACE ONCOLOGY LTD. (AU) 2020-02-04 US disclosed
US-20190076404-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF RACE ONCOLOGY LTD. (AU) 2019-03-14 US disclosed
US-20150291600-A1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS PRINCIPIA BIOPHARMA INC. 2015-10-15 US disclosed
US-20150291600-A1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS PRINCIPIA BIOPHARMA INC. 2015-10-15 US disclosed
US-20150291600-A1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS PRINCIPIA BIOPHARMA INC. 2015-10-15 US disclosed
EP-2922538-A1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS Principia Biopharma Inc. (US) 2015-09-30 EP disclosed
WO-2015013579-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE UPDATE PHARMA INC. (US) 2015-01-29 WO disclosed
WO-2015013581-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE UPDATE PHARMA INC. (US) 2015-01-29 WO disclosed
WO-2014081732-A1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-05-30 WO disclosed
WO-2014081732-A1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-05-30 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 (7 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-20200163939-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF CYP3A43, CYP11B1, MCL1 JAK3 2116/4885BTK 1276/4885ITK 4014/4885
US-11135201-B2 Compositions to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof CYP3A43, HCCS, MCL1 JAK3 2810/4885BTK 2508/4885ITK 3393/4885
US-11147800-B2 Combinatorial methods to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof CYP3A43, CYP11B1, MCL1 JAK3 2116/4885BTK 1276/4885ITK 4014/4885
US-20150291600-A1 AZAINDOLE DERIVATIVES AS JAK3 INHIBITORS JAK3, JAK2, JAK1 JAK3 1/4885BTK 92/4885ITK 921/4885
US-20200163940-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF CYP3A43, HCCS, MCL1 JAK3 2810/4885BTK 2508/4885ITK 3393/4885
US-20190076404-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF CYP3A43, CYP11B1, CYP11B2 JAK3 3201/4885BTK 2478/4885ITK 4090/4885
US-10548876-B2 Compositions to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof CYP3A43, CYP11B1, CYP11B2 JAK3 3201/4885BTK 2478/4885ITK 4090/4885

“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.