Prexasertib

Prexasertib

SCHEMBL1971000

COc1cccc(OCCCN)c1-c1cc(Nc2cnc(C#N)cn2)n[nH]1.O=CO

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHEK1CHEK2

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

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHEK1 known ✓ O14757 18/20 0.90
CHEK2 known ✓ O96017 1/20 0.90
KCNH2 Q12809 15/20 0.90
NUAK1 O60285 1/20 0.90
RPS6KB1 P23443 1/20 0.90
FLT3 P36888 1/20 0.90
BLK P51451 1/20 0.90
PRKAG1 P54619 1/20 0.90
PRKAA1 Q13131 1/20 0.90
PRKAB1 Q9Y478 1/20 0.90

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
Prexasertib SCHEMBL30093126 1.00 CHEK1 (0.90) CHEK1KCNH2NUAK1CHEK2RPS6KB1
Prexasertib SCHEMBL30528862 0.95 CHEK1 (1.00) CHEK1KCNH2NUAK1CHEK2RPS6KB1
Prexasertib SCHEMBL29371799 0.95 CHEK1 (1.00) CHEK1KCNH2NUAK1CHEK2RPS6KB1
Prexasertib SCHEMBL30517001 0.95 CHEK1 (1.00) CHEK1KCNH2NUAK1CHEK2RPS6KB1
Prexasertib SCHEMBL1975451 0.95 CHEK1 (1.00) CHEK1KCNH2NUAK1CHEK2RPS6KB1
Prexasertib SCHEMBL29838776 0.94 CHEK1 (0.98) CHEK1KCNH2NUAK1CHEK2RPS6KB1
Prexasertib SCHEMBL20668254 0.94 CHEK1 (0.98) CHEK1KCNH2NUAK1CHEK2RPS6KB1
Prexasertib SCHEMBL28527965 0.94 CHEK1 (0.98) CHEK1KCNH2NUAK1CHEK2RPS6KB1
Prexasertib SCHEMBL1971724 0.93 CHEK1 (0.90) CHEK1KCNH2NUAK1CHEK2RPS6KB1
Prexasertib SCHEMBL20591301 0.93 CHEK1 (0.90) CHEK1KCNH2NUAK1CHEK2RPS6KB1

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-20220378745-A1 CHK1/2 INHIBITORS FOR USE IN THE TREATMENT OF NEUROBLASTOMAS AND/OR SOFT TISSUE SARCOMAS ELI LILLY AND COMPANY 2022-12-01 US claimed
US-11123326-B2 CHK1/2 inhibitors and irinotecan for use in the treatment of rhabdomyosarcoma ELI LILLY AND COMPANY (US) 2021-09-21 US claimed
US-20180369202-A1 CHK1/2 Inhibitors for Use in the Treatment of Neuroblastomas and/or Soft Tissue Sarcomas ELI LILLY AND COMPANY 2018-12-27 US claimed
EP-3325468-A1 CHK1/2 INHIBITORS FOR USE IN THE TREATMENT OF NEUROBLASTOMAS AND/OR SOFT TISSUE SARCOMAS Eli Lilly and Company (US) 2018-05-30 EP claimed
WO-2017015124-A1 CHK1/2 INHIBITORS FOR USE IN THE TREATMENT OF NEUROBLASTOMAS AND/OR SOFT TISSUE SARCOMAS ELI LILLY AND COMPANY (US) 2017-01-26 WO claimed
EP-2379532-B1 COMPOUNDS USEFUL FOR INHIBITING CHK1 LILLY CO ELI (US) 2013-02-20 EP claimed
US-8314108-B2 5-(5-(2-(3-aminopropoxy)-6-methoxyphenyl)-1H-pyrazol-3-ylamino)pyrazine-2-carbonitrile, pharmaceutically acceptable salts thereof, or solvate of salts ELI LILLY AND COMPANY (US) 2012-11-20 US claimed
EP-2379532-A1 COMPOUNDS USEFUL FOR INHIBITING CHK1 Eli Lilly and Company (US) 2011-10-26 EP claimed
US-20110144126-A1 COMPOUNDS USEFUL FOR INHIBITING CHK1 ELI LILLY AND COMPANY 2011-06-16 US claimed
WO-2010077758-A1 COMPOUNDS USEFUL FOR INHIBITING CHK1 ELI LILLY AND COMPANY (US) 2010-07-08 WO claimed
US-20220378745-A1 CHK1/2 INHIBITORS FOR USE IN THE TREATMENT OF NEUROBLASTOMAS AND/OR SOFT TISSUE SARCOMAS ELI LILLY AND COMPANY 2022-12-01 US disclosed
US-11123326-B2 CHK1/2 inhibitors and irinotecan for use in the treatment of rhabdomyosarcoma ELI LILLY AND COMPANY (US) 2021-09-21 US disclosed
CN-108349948-B 5- (5- (2- (3-aminopropoxy) -6-methoxyphenyl) -1H-pyrazol-3-ylamino) pyrazine-2-carbonitrile (S) -lactate monohydrate 伊莱利利公司 2021-02-23 CN disclosed
EP-3325468-B1 CHK1/2 INHIBITORS FOR USE IN THE TREATMENT OF NEUROBLASTOMAS AND/OR SOFT TISSUE SARCOMAS LILLY CO ELI (US) 2020-11-11 EP disclosed
EP-3389660-B1 COMBINATION THERAPY FOR CANCER LILLY CO ELI (US) 2019-10-16 EP disclosed
EP-2379532-B1 COMPOUNDS USEFUL FOR INHIBITING CHK1 LILLY CO ELI (US) 2013-02-20 EP disclosed
US-8314108-B2 5-(5-(2-(3-aminopropoxy)-6-methoxyphenyl)-1H-pyrazol-3-ylamino)pyrazine-2-carbonitrile, pharmaceutically acceptable salts thereof, or solvate of salts ELI LILLY AND COMPANY (US) 2012-11-20 US disclosed
EP-2379532-A1 COMPOUNDS USEFUL FOR INHIBITING CHK1 Eli Lilly and Company (US) 2011-10-26 EP disclosed
US-20110144126-A1 COMPOUNDS USEFUL FOR INHIBITING CHK1 ELI LILLY AND COMPANY 2011-06-16 US disclosed
WO-2010077758-A1 COMPOUNDS USEFUL FOR INHIBITING CHK1 ELI LILLY AND COMPANY (US) 2010-07-08 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 (4 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-20180369202-A1 CHK1/2 Inhibitors for Use in the Treatment of Neuroblastomas and/or Soft Tissue Sarcomas CHEK1, CHEK2, PLK1 CHEK1 1/4885CHEK2 2/4885KCNH2 3234/4885
US-20110144126-A1 COMPOUNDS USEFUL FOR INHIBITING CHK1 CHEK1, CHEK2, PLK1 CHEK1 1/4885CHEK2 2/4885KCNH2 3087/4885
US-20220378745-A1 CHK1/2 INHIBITORS FOR USE IN THE TREATMENT OF NEUROBLASTOMAS AND/OR SOFT TISSUE SARCOMAS CHEK1, CHEK2, PLK1 CHEK1 1/4885CHEK2 2/4885KCNH2 3382/4885
US-11123326-B2 CHK1/2 inhibitors and irinotecan for use in the treatment of rhabdomyosarcoma CHEK1, CHEK2, TOP2A CHEK1 1/4885CHEK2 2/4885KCNH2 3724/4885

“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.