SCHEMBL1641583

SCHEMBL1641583

Cn1nccc1-c1cnc(C(=O)N[C@H](CN)Cc2cccc(F)c2)s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 8/20 0.57
AKT2 P31751 6/20 0.57
AKT3 Q9Y243 6/20 0.57
ROCK1 Q13464 4/20 0.57
PRKCA P17252 3/20 0.57
ROCK2 O75116 2/20 0.57
PRKCB P05771 2/20 0.57
PRKACA P17612 2/20 0.57
PRKACB P22694 2/20 0.57
PKN1 Q16512 2/20 0.57
PRKD2 Q9BZL6 2/20 0.57
CIT O14578 1/20 0.57
EGFR P00533 1/20 0.47
PIM1 P11309 1/20 0.47
SYK P43405 1/20 0.47
MAPKAPK2 P49137 1/20 0.47
GSK3B P49841 1/20 0.47
MAPK14 Q16539 1/20 0.47
PIN1 Q13526 3/20 0.43
SGK1 O00141 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
SCHEMBL28534564 1.00 AKT1 (0.57) AKT1AKT2AKT3ROCK1PRKCA
SCHEMBL28537816 0.86 AKT1 (0.58) AKT1AKT2AKT3ROCK1PRKCA
SCHEMBL1591842 0.86 AKT1 (0.58) AKT1AKT2AKT3ROCK1PRKCA
SCHEMBL1641424 0.86 AKT1 (0.45) AKT1AKT2AKT3ROCK1PRKCA
SCHEMBL12766573 0.84 AKT1 (0.74) AKT1AKT2AKT3ROCK1PRKCA
SCHEMBL2057742 0.84 ROCK1 (0.51) AKT1AKT2AKT3ROCK1PRKCA
SCHEMBL1591736 0.84 AKT1 (0.59) AKT1AKT2AKT3ROCK1PRKCA
SCHEMBL1529491 0.83 AKT1 (0.63) AKT1AKT2AKT3ROCK1PRKCA
SCHEMBL13509109 0.82 AKT1 (0.74) AKT1AKT2AKT3ROCK1PRKCA
SCHEMBL1529390 0.82 AKT1 (0.74) AKT1AKT2AKT3ROCK1PRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110098221-A1 INHIBITORS OF Akt ACTIVITY GLAXOSMITHKLINE LLC 2011-04-28 US 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
EP-3860575-A1 METHOD FOR PREPARING AND DELIVERING BISANTRENE FORMULATIONS Race Oncology Ltd. (AU) 2021-08-11 EP 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-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-20200163940-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF RACE ONCOLOGY LTD. (AU) 2020-05-28 US disclosed
WO-2020072948-A1 METHOD FOR PREPARING AND DELIVERING BISANTRENE FORMULATIONS RACE ONCOLOGY LTD. (AU) 2020-04-09 WO disclosed
US-20160220537-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF RACE ONCOLOGY LTD. (AU) 2016-08-04 US disclosed
US-20160166546-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF RACE ONCOLOGY LTD. (AU) 2016-06-16 US disclosed
EP-3024456-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE Update Pharma Inc. (US) 2016-06-01 EP disclosed
EP-3024457-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE Update Pharma Inc. (US) 2016-06-01 EP disclosed
WO-2015013581-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE UPDATE PHARMA INC. (US) 2015-01-29 WO disclosed
WO-2015013579-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE UPDATE PHARMA INC. (US) 2015-01-29 WO disclosed
US-20110098221-A1 INHIBITORS OF Akt ACTIVITY GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
US-20110098221-A1 INHIBITORS OF Akt ACTIVITY GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
US-20110098221-A1 INHIBITORS OF Akt ACTIVITY GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
WO-2009158373-A1 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2009-12-30 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 (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-20200163939-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF CYP3A43, CYP11B1, MCL1 AKT1 1216/4885AKT2 1329/4885AKT3 1098/4885
US-11135201-B2 Compositions to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof CYP3A43, HCCS, MCL1 AKT1 1236/4885AKT2 1565/4885AKT3 1286/4885
US-11147800-B2 Combinatorial methods to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof CYP3A43, CYP11B1, MCL1 AKT1 1216/4885AKT2 1329/4885AKT3 1098/4885
US-20110098221-A1 INHIBITORS OF Akt ACTIVITY AKT2, AKT1, PIK3CA AKT1 2/4885AKT2 1/4885AKT3 7/4885
US-20210379021-A1 METHOD FOR PREPARING AND DELIVERING BISANTRENE FORMULATIONS CYP3A43, CYP1A1, UGT1A3 AKT1 3945/4885AKT2 4183/4885AKT3 4012/4885
US-20200163940-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF CYP3A43, HCCS, MCL1 AKT1 1236/4885AKT2 1565/4885AKT3 1286/4885
US-20160220537-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF CYP3A43, CYP11B1, CYP11B2 AKT1 1680/4885AKT2 1869/4885AKT3 1641/4885
US-20160166546-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF CYP3A43, CYP11B1, MCL1 AKT1 1216/4885AKT2 1329/4885AKT3 1098/4885

“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.