SCHEMBL17005371

SCHEMBL17005371

Clc1cnc2c(I)c[nH]c2n1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.49
CHEK1 O14757 1/20 0.42
BRD4 O60885 1/20 0.31

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
SCHEMBL31229864 1.00 MAPK1 (0.49) MAPK1CHEK1BRD4
SCHEMBL30259037 0.85 MAPK1 (0.62) MAPK1CHEK1BRD4
SCHEMBL650607 0.85 MAPK1 (0.62) MAPK1CHEK1BRD4
SCHEMBL18330446 0.77 MAPK1 (0.52) MAPK1
SCHEMBL21820855 0.77 MAPK1 (0.49) MAPK1CHEK1BRD4
SCHEMBL23443035 0.77 MAPK1 (0.30) MAPK1
SCHEMBL25122512 0.74
SCHEMBL31229806 0.73 LRRK2 (0.45)
SCHEMBL31229811 0.73 CYP11B1 (0.35)
SCHEMBL23830299 0.73 KMT2A (0.40)

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11634424-B2 Diazaindole derivative and use thereof as CHK1 inhibitor MEDSHINE DISCOVERY INC. (CN) 2023-04-25 US disclosed
EP-3555095-B1 INHIBITORS OF INFLUENZA VIRUS REPLICATION AND USES THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2023-04-12 EP disclosed
US-20230017858-A1 DIAZAINDOLE DERIVATIVE AND USE THEREOF AS CHK1 INHIBITOR Shanghai Fosun Pharmaceutical Industrial Development Co., Ltd. (CN) 2023-01-19 US disclosed
US-11466016-B2 Pharmaceutical compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2022-10-11 US disclosed
WO-2021104461-A1 DIAZAINDOLE DERIVATIVE AND USE THEREOF AS CHK1 INHIBITOR 南京明德新药研发有限公司 2021-06-03 WO disclosed
US-10987354-B2 Inhibitors of influenza virus replication and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-04-27 US disclosed
US-20210107908-A1 PHARMACEUTICAL COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2021-04-15 US disclosed
US-20210107908-A1 PHARMACEUTICAL COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2021-04-15 US disclosed
CN-108218873-B Inhibitors of influenza virus replication and uses thereof 广东东阳光药业有限公司 2020-07-07 CN disclosed
US-20200085822-A1 INHIBITORS OF INFLUENZA VIRUS REPLICATION AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2020-03-19 US disclosed
EP-2933248-B1 NOVEL RENIN INHIBITOR MITSUBISHI TANABE PHARMA CORP (JP) 2018-01-31 EP disclosed
US-9556159-B2 Renin inhibitor MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-01-31 US disclosed
US-9556159-B2 Renin inhibitor MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-01-31 US disclosed
US-9556159-B2 Renin inhibitor MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-01-31 US disclosed
EP-2933248-A1 NOVEL RENIN INHIBITOR Mitsubishi Tanabe Pharma Corporation (JP) 2015-10-21 EP disclosed
EP-2933248-A1 NOVEL RENIN INHIBITOR Mitsubishi Tanabe Pharma Corporation (JP) 2015-10-21 EP disclosed
US-20150232459-A1 NOVEL RENIN INHIBITOR SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2015-08-20 US disclosed
US-20150232459-A1 NOVEL RENIN INHIBITOR SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2015-08-20 US disclosed
US-20150232459-A1 NOVEL RENIN INHIBITOR SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2015-08-20 US 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-20230017858-A1 DIAZAINDOLE DERIVATIVE AND USE THEREOF AS CHK1 INHIBITOR CHEK1, CHEK2, DDB1 MAPK1 1594/4885CHEK1 1/4885BRD4 623/4885
US-20210107908-A1 PHARMACEUTICAL COMPOUNDS MAPT, CYP3A5, SLC5A1 MAPK1 2041/4885CHEK1 3679/4885BRD4 1549/4885
US-10987354-B2 Inhibitors of influenza virus replication and uses thereof ZC3HAV1, MAVS, POLRMT MAPK1 2020/4885CHEK1 1527/4885BRD4 1110/4885
US-20150232459-A1 NOVEL RENIN INHIBITOR REN, AGTR1, ACE MAPK1 281/4885CHEK1 4214/4885BRD4 358/4885
US-11634424-B2 Diazaindole derivative and use thereof as CHK1 inhibitor CHEK1, CHEK2, DDB1 MAPK1 1594/4885CHEK1 1/4885BRD4 623/4885
US-11466016-B2 Pharmaceutical compounds MAPT, CYP3A5, SLC5A1 MAPK1 2041/4885CHEK1 3679/4885BRD4 1549/4885
US-20200085822-A1 INHIBITORS OF INFLUENZA VIRUS REPLICATION AND USES THEREOF ZC3HAV1, MAVS, POLRMT MAPK1 2020/4885CHEK1 1527/4885BRD4 1110/4885

“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.