SCHEMBL2301031

SCHEMBL2301031

Cn1ncc(Cl)c1-c1cc(NC(=O)C(CN)c2ccccc2)sc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 7/20 0.49
ROCK1 Q13464 6/20 0.49
ROCK2 O75116 5/20 0.49
AKT2 P31751 3/20 0.49
AKT3 Q9Y243 3/20 0.49
PRKCB P05771 2/20 0.49
PRKCA P17252 2/20 0.49
PRKACA P17612 2/20 0.49
PRKACB P22694 2/20 0.49
PKN1 Q16512 2/20 0.49
PRKD2 Q9BZL6 2/20 0.49
CIT O14578 1/20 0.49
GLS O94925 5/20 0.42
MYLK4 Q86YV6 3/20 0.38
SGK1 O00141 1/20 0.38
PRKD3 O94806 1/20 0.38
LATS1 O95835 1/20 0.38
PRKCG P05129 1/20 0.38
RPS6KB1 P23443 1/20 0.38
PRKCH P24723 1/20 0.38

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
SCHEMBL2302178 0.85 AKT1 (0.56) AKT1ROCK1ROCK2AKT2AKT3
SCHEMBL2301203 0.85 AKT1 (0.56) AKT1ROCK1ROCK2AKT2AKT3
SCHEMBL2300062 0.85 AKT1 (0.56) AKT1ROCK1ROCK2AKT2AKT3
SCHEMBL28524757 0.80 AKT1 (0.53) AKT1ROCK1ROCK2AKT2AKT3
SCHEMBL2301762 0.80 AKT1 (0.53) AKT1ROCK1ROCK2AKT2AKT3
SCHEMBL2304544 0.80 AKT1 (0.53) AKT1ROCK1ROCK2AKT2AKT3
SCHEMBL2302980 0.78 AKT1 (0.56) AKT1ROCK1ROCK2AKT2AKT3
SCHEMBL2300200 0.78 AKT1 (0.56) AKT1ROCK1ROCK2AKT2AKT3
SCHEMBL28523203 0.78 AKT1 (0.56) AKT1ROCK1ROCK2AKT2AKT3
SCHEMBL1529711 0.78 AKT1 (0.63) AKT1ROCK1ROCK2AKT2AKT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8592475-B2 Inhibitors of Akt activity GLAXOSMITHKLINE LLC (US) 2013-11-26 US claimed
US-20110196009-A1 INHIBITORS OF Akt ACTIVITY SMITHKLINE BEECHAM CORPORATION 2011-08-11 US claimed
WO-2010045309-A1 INHIBITORS OF AKT ACTIVITY GLAXOSMITHKLINE LLC (US) 2010-04-22 WO claimed
US-20210379021-A1 METHOD FOR PREPARING AND DELIVERING BISANTRENE FORMULATIONS RACE ONCOLOGY LTD (AU) 2021-12-09 US disclosed
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-113365610-A Methods of making and delivering bisantrene formulations 现代化制药公司 2021-09-07 CN 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
EP-3024456-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE Update Pharma Inc. (US) 2016-06-01 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
US-8592475-B2 Inhibitors of Akt activity GLAXOSMITHKLINE LLC (US) 2013-11-26 US disclosed
US-20110196009-A1 INHIBITORS OF Akt ACTIVITY SMITHKLINE BEECHAM CORPORATION 2011-08-11 US disclosed
US-20110196009-A1 INHIBITORS OF Akt ACTIVITY SMITHKLINE BEECHAM CORPORATION 2011-08-11 US disclosed
US-20110196009-A1 INHIBITORS OF Akt ACTIVITY SMITHKLINE BEECHAM CORPORATION 2011-08-11 US disclosed
WO-2010045309-A1 INHIBITORS OF AKT ACTIVITY GLAXOSMITHKLINE LLC (US) 2010-04-22 WO disclosed
WO-2010045309-A1 INHIBITORS OF AKT ACTIVITY GLAXOSMITHKLINE LLC (US) 2010-04-22 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 AKT1 1216/4885ROCK1 1875/4885ROCK2 2335/4885
US-20110196009-A1 INHIBITORS OF Akt ACTIVITY AKT2, AKT1, AKT3 AKT1 2/4885ROCK1 634/4885ROCK2 696/4885
US-11135201-B2 Compositions to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof CYP3A43, HCCS, MCL1 AKT1 1236/4885ROCK1 1421/4885ROCK2 2328/4885
US-11147800-B2 Combinatorial methods to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof CYP3A43, CYP11B1, MCL1 AKT1 1216/4885ROCK1 1875/4885ROCK2 2335/4885
US-20210379021-A1 METHOD FOR PREPARING AND DELIVERING BISANTRENE FORMULATIONS CYP3A43, CYP1A1, UGT1A3 AKT1 3945/4885ROCK1 2034/4885ROCK2 2762/4885
US-20200163940-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF CYP3A43, HCCS, MCL1 AKT1 1236/4885ROCK1 1421/4885ROCK2 2328/4885
US-10548876-B2 Compositions to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof CYP3A43, CYP11B1, CYP11B2 AKT1 1680/4885ROCK1 1476/4885ROCK2 2237/4885

“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.