SCHEMBL4742382

SCHEMBL4742382

COc1ccc(COCCOS(C)(=O)=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APLNR P35414 2/20 0.51
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
IDO1 P14902 2/20 0.46
AGXT P21549 2/20 0.46
APP P05067 7/20 0.45
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
PKM P14618 2/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
CA12 O43570 1/20 0.41
CA5A P35218 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL15532153 0.98 APLNR (0.50) APLNRTDP1L3MBTL1IDO1AGXT
SCHEMBL22750781 0.90 L3MBTL1 (0.56) APLNRTDP1L3MBTL1IDO1AGXT
SCHEMBL7240629 0.85 APLNR (0.50) APLNRTDP1APPCA1CA2
SCHEMBL5937187 0.84 APLNR (0.59) APLNRIDO1AGXTAPPCA1
SCHEMBL8499580 0.84 IDO1 (0.61) TDP1L3MBTL1IDO1AGXTAPP
SCHEMBL1109816 0.83 CA2 (0.53) AGXTCA1CA2PKMHTT
SCHEMBL3124649 0.81 IDO1 (0.41) L3MBTL1IDO1AGXTAPPCA1
SCHEMBL1109812 0.81 KMT2A (0.42) IDO1AGXTCA2PKMHTT
SCHEMBL12456802 0.81 PTGS2 (0.51) APLNRTDP1L3MBTL1IDO1AGXT
SCHEMBL16682543 0.81 CA2 (0.51) AGXTCA1CA2PKMHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240190893-A1 MACROCYCLIC 1,3-BRIDGED 6-CHLORO-7-PYRAZOL-4-YL-1 H-INDOLE-2-CARBOXYLATE AND 6-CHLORO-7-PYRIMIDIN-5-YL-1H-INDOLE-2-CARBOXYLATE DERIVATIVES AS MCL-1 INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA NV (BE) 2024-06-13 US disclosed
EP-4291564-A1 MACROCYCLIC 1,3-BRIDGED 6-CHLORO-7-PYRAZOL-4-YL-1H-INDOLE-2-CARBOXYLATE AND 6-CHLORO-7-PYRIMIDIN-5-YL-1H-INDOLE-2-CARBOXYLATE DERIVATIVES AS MCL-1 INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN Pharmaceutica NV (BE) 2023-12-20 EP disclosed
CN-116848126-A Macrocyclic 1, 3-bridged 6-chloro-7-pyrazol-4-yl-1H-indole-2-carboxylic acid esters and 6-chloro-7-pyrimidin-5-yl-1H-indole-2-carboxylic acid ester derivatives as MCL-1 inhibitors for the treatment of cancer 詹森药业有限公司 2023-10-03 CN disclosed
WO-2022171782-A1 MACROCYCLIC 1,3-BRIDGED 6-CHLORO-7-PYRAZOL-4-YL-1H-INDOLE-2-CARBOXYLATE AND 6-CHLORO-7-PYRIMIDIN-5-YL-1H-INDOLE-2-CARBOXYLATE DERIVATIVES AS MCL-1 INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA NV (BE) 2022-08-18 WO disclosed
US-10478423-B2 Substituted indazole derivatives active as kinase inhibitiors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2019-11-19 US disclosed
US-20180289672-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITIORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2018-10-11 US disclosed
US-10028934-B2 Substituted indazole derivatives active as kinase inhibitiors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2018-07-24 US disclosed
US-9597317-B2 Substituted indazole derivatives active as kinase inhibitiors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2017-03-21 US disclosed
EP-2707359-B1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2016-11-30 EP disclosed
US-20160311776-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITIORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2016-10-27 US disclosed
US-20160310465-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITIORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2016-10-27 US disclosed
US-9408850-B2 Substituted indazole derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2016-08-09 US disclosed
CN-103534239-B There is the indazole derivatives of the replacement of kinase inhibitory activity NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2016-04-20 CN disclosed
US-20140080807-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2014-03-20 US disclosed
EP-2707359-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2014-03-19 EP disclosed
WO-2012152763-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-11-15 WO disclosed
WO-2008096093-A1 OXAZOLE AND THIAZOLE DERIVATIVES AND THEIR USES ARGENTA DISCOVERY LTD. (GB) 2008-08-14 WO disclosed
WO-2008096093-A1 OXAZOLE AND THIAZOLE DERIVATIVES AND THEIR USES ARGENTA DISCOVERY LTD. (GB) 2008-08-14 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-20140080807-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS MAP3K1, MAP3K20, MAP3K19 APLNR 3667/4885TDP1 1141/4885L3MBTL1 3199/4885
US-20240190893-A1 MACROCYCLIC 1,3-BRIDGED 6-CHLORO-7-PYRAZOL-4-YL-1 H-INDOLE-2-CARBOXYLATE AND 6-CHLORO-7-PYRIMIDIN-5-YL-1H-INDOLE-2-CARBOXYLATE DERIVATIVES AS MCL-1 INHIBITORS FOR THE TREATMENT OF CANCER MCL1, BCL9, BCL9L APLNR 1923/4885TDP1 2075/4885L3MBTL1 103/4885
US-20160310465-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITIORS MAP3K20, MAP3K1, MAP3K5 APLNR 3193/4885TDP1 1218/4885L3MBTL1 3345/4885
US-10028934-B2 Substituted indazole derivatives active as kinase inhibitiors MAP3K20, MAP3K1, MAP3K5 APLNR 3193/4885TDP1 1218/4885L3MBTL1 3345/4885
US-20160311776-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITIORS MAP3K20, MAP3K1, MAP3K5 APLNR 3193/4885TDP1 1218/4885L3MBTL1 3345/4885
US-10478423-B2 Substituted indazole derivatives active as kinase inhibitiors MAP3K20, MAP3K1, MAP3K5 APLNR 3193/4885TDP1 1218/4885L3MBTL1 3345/4885
US-20180289672-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITIORS MAP3K20, MAP3K1, MAP3K5 APLNR 3193/4885TDP1 1218/4885L3MBTL1 3345/4885

“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.