SCHEMBL986438

SCHEMBL986438

COC(=O)c1cncc2cc[nH]c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 2/20 0.41
▸ CHUK O15111 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ CDK8 P49336 1/20 0.41
▸ PIM1 P11309 1/20 0.41
▸ PIM3 Q86V86 1/20 0.41
▸ KEAP1 Q14145 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CHEK1 O14757 2/20 0.39
▸ PDPK1 O15530 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ AXL P30530 1/20 0.38
▸ NR4A2 P43354 1/20 0.38
▸ MAP2K1 Q02750 1/20 0.38

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
SCHEMBL3424440 0.83 NUDT1 (0.48) KDM4EALDH1A1LMNATSHR
SCHEMBL3425595 0.80 KEAP1 (0.58) IKBKBCHUKKDM4EALDH1A1GAA
SCHEMBL30050554 0.80 KEAP1 (0.58) IKBKBCHUKKDM4EALDH1A1GAA
SCHEMBL1442009 0.78 PDPK1 (0.59) IKBKBCHUKKEAP1CHEK1PDPK1
SCHEMBL29800264 0.78 PDPK1 (0.59) IKBKBCHUKKEAP1CHEK1PDPK1
SCHEMBL20542164 0.77 PIM3 (0.44) IKBKBCHUKCDK8PIM1PIM3
SCHEMBL30136593 0.77 KEAP1 (0.64) KDM4EPIM1PIM3KEAP1LMNA
Hydrochloric Acid SCHEMBL1440567 0.77 PDPK1 (0.57) IKBKBCHUKKEAP1CHEK1PDPK1
SCHEMBL761721 0.77 KEAP1 (0.64) KDM4EPIM1PIM3KEAP1LMNA
SCHEMBL30410090 0.75 TSHR (0.51) KDM4EALDH1A1GLAGAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110891935-B Bicyclic compounds and their use in cancer treatment 泰普斯特医疗公司 2023-12-01 — — CN disclosed
US-11738009-B2 Bicyclic compounds and their use in the treatment of cancer TEMPEST THERAPEUTICS, INC. (US) 2023-08-29 — — US disclosed
US-11638704-B2 Bicyclic compounds and their use in the treatment of cancer TEMPEST THERAPEUTICS, INC. (US) 2023-05-02 — — US disclosed
EP-4008328-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS AbbVie Inc. (US) 2022-06-08 — — EP disclosed
EP-4008328-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS AbbVie Inc. (US) 2022-06-08 — — EP disclosed
US-20210387985-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER TEMPEST THERAPEUTICS, INC. 2021-12-16 — — US disclosed
US-11066405-B2 Bicyclic compounds and their use in the treatment of cancer TEMPEST THERAPEUTICS, INC. (US) 2021-07-20 — — US disclosed
US-20210179556-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. 2021-06-17 — — US disclosed
US-20210179556-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. 2021-06-17 — — US disclosed
US-20210008046-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER TEMPEST THERAPEUTICS, INC. 2021-01-14 — — US disclosed
WO-2014210255-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. (US) 2014-12-31 — — WO disclosed
US-8598355-B2 Amide compound ASTELLAS PHARMA INC. (JP) 2013-12-03 — — US disclosed
EP-2565191-A1 4-(Indol-7-ylcarbonylaminomethyl)cyclohexanecarboxylic acid derivatives as EP4 receptor antagonists useful for the treatment of chronic renal failure or diabetic nephropathy Astellas Pharma Inc. (JP) 2013-03-06 — — EP disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 — — US disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 — — US disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 — — US disclosed
CN-102026961-A Amide compound ASTELLAS PHARMA INC 2011-04-20 — — CN disclosed
EP-2277858-A1 AMIDE COMPOUND Astellas Pharma Inc. (JP) 2011-01-26 — — EP disclosed
EP-2277858-A1 AMIDE COMPOUND Astellas Pharma Inc. (JP) 2011-01-26 — — EP disclosed
WO-2009139373-A1 AMIDE COMPOUND アステラス製薬株式会社 (JP) 2009-11-19 — — 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-11066405-B2 Bicyclic compounds and their use in the treatment of cancer PTGER4, PTGER1, PTGER3 IKBKB 161/4885CHUK 43/4885KDM4E 1723/4885
US-20210008046-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER PTGER4, PTGER1, PTGER3 IKBKB 161/4885CHUK 43/4885KDM4E 1723/4885
US-11738009-B2 Bicyclic compounds and their use in the treatment of cancer PTGER4, PTGER1, PTGER3 IKBKB 161/4885CHUK 43/4885KDM4E 1723/4885
US-20210179556-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS BTK, SYK, MYD88 IKBKB 58/4885CHUK 21/4885KDM4E 591/4885
US-20110144153-A1 AMIDE COMPOUND PTGER4, PTGER1, PTGER2 IKBKB 1238/4885CHUK 255/4885KDM4E 959/4885
US-20210387985-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER PTGER4, PTGER1, PTGER3 IKBKB 143/4885CHUK 40/4885KDM4E 1683/4885
US-11638704-B2 Bicyclic compounds and their use in the treatment of cancer PTGER4, PTGER1, PTGER3 IKBKB 143/4885CHUK 40/4885KDM4E 1683/4885

“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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