SCHEMBL3161665

SCHEMBL3161665

NC(=O)[CH]c1ccc(F)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G7 Q13093 2/20 0.49
▸ CES2 O00748 1/20 0.45
▸ CES1 P23141 1/20 0.45
▸ NFE2L2 Q16236 2/20 0.44
▸ PTGS2 P35354 1/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ KCNN4 O15554 1/20 0.41
▸ CYP1A1 P04798 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP1B1 Q16678 1/20 0.41
▸ GRIN1 Q05586 1/20 0.41
▸ GRIN2B Q13224 1/20 0.41
▸ NPC1 O15118 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL15023129 0.82 KIF11 (0.46) PLA2G7GAAIDO1
SCHEMBL3181345 0.82 IDO1 (0.45) CA2NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL3176520 0.82 KCNA3 (0.39) PLA2G7ALDH1A1KMT2AIDO1
SCHEMBL8153637 0.82 PTGS2 (0.53) PLA2G7CES2CES1NFE2L2PTGS2
SCHEMBL7621027 0.82 PTGS2 (0.53) PLA2G7CES2CES1NFE2L2PTGS2
SCHEMBL3182714 0.79 KIF11 (0.51) CES2KCNN4
SCHEMBL2400367 0.79 NR3C2 (0.41) —
SCHEMBL16649614 0.77 CYP11B2 (0.47) TRPA1
SCHEMBL16649771 0.77 CES2 (0.46) PLA2G7CES2CES1CA12CA1
SCHEMBL16649745 0.76 PLA2G7 (0.44) PLA2G7CES2CES1NFE2L2PTGS2

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-20220133718-A1 PHARMACEUTICAL FORMULATIONS, PROCESSES FOR PREPARATION, AND METHODS OF USE OXFORD FINANCE LLC, AS COLLATERAL AGENT 2022-05-05 — — US claimed
US-20200390764-A1 PHARMACEUTICAL FORMULATIONS, PROCESSES FOR PREPARATION, AND METHODS OF USE VIRACTA THERAPEUTICS, INC. 2020-12-17 — — US claimed
US-20190175589-A1 PHARMACEUTICAL FORMULATIONS, PROCESSES FOR PREPARATION, AND METHODS OF USE SUNESIS PHARMACEUTICALS, INC. 2019-06-13 — — US claimed
US-20240207258-A1 HETEROCYCLIC PDK1 INHIBITORS FOR USE TO TREAT CANCER OXFORD FINANCE LLC, AS COLLATERAL AGENT 2024-06-27 — — US disclosed
EP-3466929-B1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS MILLENNIUM PHARM INC (US) 2023-09-06 — — EP disclosed
US-20230113598-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS BIOGEN IDEC MA INC. 2023-04-13 — — US disclosed
US-20230099829-A1 HETEROCYCLIC PDK1 INHIBITORS FOR USE TO TREAT CANCER VIRACTA THERAPEUTICS, INC. 2023-03-30 — — US disclosed
US-20220133718-A1 PHARMACEUTICAL FORMULATIONS, PROCESSES FOR PREPARATION, AND METHODS OF USE OXFORD FINANCE LLC, AS COLLATERAL AGENT 2022-05-05 — — US disclosed
US-20210070752-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS VIRACTA THERAPEUTICS, INC. 2021-03-11 — — US disclosed
EP-3763368-A1 HETEROCYCLIC PDK1 INHIBITORS FOR USE TO TREAT CANCER Sunesis Pharmaceuticals, Inc. (US) 2021-01-13 — — EP disclosed
US-20200390764-A1 PHARMACEUTICAL FORMULATIONS, PROCESSES FOR PREPARATION, AND METHODS OF USE VIRACTA THERAPEUTICS, INC. 2020-12-17 — — US disclosed
EP-3070077-B1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS MILLENNIUM PHARM INC (US) 2018-11-28 — — EP disclosed
US-10030016-B2 Heterocyclic compounds useful as PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2018-07-24 — — US disclosed
US-9546165-B2 Heterocyclic compounds useful as PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2017-01-17 — — US disclosed
US-20160331756-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2016-11-17 — — US disclosed
EP-3070077-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS Millennium Pharmaceuticals, Inc. (US) 2016-09-21 — — EP disclosed
EP-2485731-B1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS MILLENNIUM PHARM INC (US) 2016-05-11 — — EP disclosed
EP-2121617-B1 CB1 RECEPTOR MODULATORS 7TM PHARMA AS (DK) 2014-01-22 — — EP disclosed
US-20120208819-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2012-08-16 — — US disclosed
US-20100010061-A1 CB1 RECEPTOR MODULATORS 7TM PHARMA A/S (DK) 2010-01-14 — — 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 (11 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-20120208819-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 PLA2G7 1285/4885CES2 3357/4885CES1 1238/4885
US-20190175589-A1 PHARMACEUTICAL FORMULATIONS, PROCESSES FOR PREPARATION, AND METHODS OF USE PRKCA, PIK3CA, AKT2 PLA2G7 549/4885CES2 3507/4885CES1 2587/4885
US-20220133718-A1 PHARMACEUTICAL FORMULATIONS, PROCESSES FOR PREPARATION, AND METHODS OF USE PRKCA, PIK3CA, AKT2 PLA2G7 549/4885CES2 3507/4885CES1 2587/4885
US-20200390764-A1 PHARMACEUTICAL FORMULATIONS, PROCESSES FOR PREPARATION, AND METHODS OF USE PRKCA, PIK3CA, AKT2 PLA2G7 549/4885CES2 3507/4885CES1 2587/4885
US-20210070752-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 PLA2G7 1285/4885CES2 3357/4885CES1 1238/4885
US-20100010061-A1 CB1 RECEPTOR MODULATORS CNR1, CNR2, GPR6 PLA2G7 1647/4885CES2 500/4885CES1 312/4885
US-10030016-B2 Heterocyclic compounds useful as PDK1 inhibitors PDK1, PDK2, PDK3 PLA2G7 1285/4885CES2 3357/4885CES1 1238/4885
US-20160331756-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 PLA2G7 1285/4885CES2 3357/4885CES1 1238/4885
US-20230099829-A1 HETEROCYCLIC PDK1 INHIBITORS FOR USE TO TREAT CANCER PDK1, PDK2, PDK3 PLA2G7 2657/4885CES2 3808/4885CES1 2128/4885
US-20230113598-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 PLA2G7 1285/4885CES2 3357/4885CES1 1238/4885
US-20240207258-A1 HETEROCYCLIC PDK1 INHIBITORS FOR USE TO TREAT CANCER PDK1, PDK2, PDK3 PLA2G7 2657/4885CES2 3808/4885CES1 2128/4885

“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.

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