SCHEMBL5697291

SCHEMBL5697291

CCC(=O)CC1C(=O)CCCC1=O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
MAPT P10636 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TDP1 Q9NUW8 1/20 0.36
GAA P10253 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CYP2D6 P10635 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
SCHEMBL1004976 0.78 ALDH1A1 (0.52) ALDH1A1MAPTL3MBTL1GAACA1
SCHEMBL13545147 0.76 PTGS1 (0.44) ALDH1A1GAACA1CA2CA4
SCHEMBL9816728 0.75 NPC1 (0.47) ALDH1A1GAACA1CA2CA4
Water SCHEMBL9787126 0.73 CYP2D6 (0.47) ALDH1A1MAPTL3MBTL1TDP1GAA
SCHEMBL8639644 0.73 ALDH1A1 (0.46) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C9
SCHEMBL1654265 0.72 MAPT (0.48) ALDH1A1MAPTL3MBTL1GAACYP1A2
Calcium SCHEMBL31193385 0.71 ALDH1A1 (0.45) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C9
Bicarbonate SCHEMBL8638060 0.70 ALDH1A1 (0.44) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C9
SCHEMBL17449502 0.69 ALDH1A1 (0.36) ALDH1A1MAPTL3MBTL1
SCHEMBL8393094 0.69 TP53 (0.39) ALDH1A1MAPTL3MBTL1GAACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111936468-B Compounds with anticancer activity 协和麒麟株式会社 2024-03-08 CN disclosed
US-20220378923-A1 BET DEGRADER KYOWA KIRIN CO., LTD. (JP) 2022-12-01 US disclosed
EP-4039333-A1 BET DEGRADER Kyowa Kirin Co., Ltd. (JP) 2022-08-10 EP disclosed
CN-114502534-A BET degradant 协和麒麟株式会社 2022-05-13 CN disclosed
WO-2021065980-A1 BET DEGRADER 協和キリン株式会社 2021-04-08 WO disclosed
CN-111936468-A Compounds with anti-cancer activity 协和麒麟株式会社 2020-11-13 CN disclosed
WO-2019189778-A1 COMPOUND WITH ANTICANCER ACTIVITY 協和発酵キリン株式会社 2019-10-03 WO disclosed
EP-1100492-B1 INDOLE sPLA2 INHIBITORS LILLY CO ELI (US) 2006-05-24 EP disclosed
US-6617460-B1 5-hydrocarbylsulfoxy-4,5,6,7-tetrahydroindol-4-one intermediates useful in the preparation of 1H-indole-3-glyoxamides. ELI LILLY AND COMPANY 2003-09-09 US disclosed
US-6570023-B1 Chemical intermediate for drug to threat sepsis shock, rheumatic diseases ELI LILLY AND COMPANY 2003-05-27 US disclosed
EP-1119546-A1 PROCESS FOR PREPARING TOLUENESULFINATES ELI LILLY AND COMPANY (US) 2001-08-01 EP disclosed
EP-1119549-A1 PROCESS FOR PREPARING 4-SUBSTITUTED-1H-INDOLE-3-GLYOXAMIDES ELI LILLY AND COMPANY (US) 2001-08-01 EP disclosed
US-6265591-B1 HALOGENATING KETO ESTER COMPOUND; HYDROLYSIS AND DECARBOXYLATION; ALKYLATING; AMINATION AND DEHYDRATION TO FORM TRIKETO COMPOUND; AMINATING; OXIDATION, ALKYLATING; REACTING INDOLE DERIVATIVE WITH OXALYL CHLORIDE AND AMMONIA ELI LILLY AND COMPANY 2001-07-24 US disclosed
EP-1100492-A1 INDOLE sPLA 2? INHIBITORS Eli Lilly & Company (US) 2001-05-23 EP disclosed
WO-2000021929-A1 PROCESS FOR PREPARING 4-SUBSTITUTED-1H-INDOLE-3-GLYOXAMIDES ELI LILLY AND COMPANY (US) 2000-04-20 WO disclosed
WO-2000021923-A1 PROCESS FOR PREPARING TOLUENESULFINATES ELI LILLY AND COMPANY (US) 2000-04-20 WO disclosed
WO-2000007590-A1 INDOLE sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 2000-02-17 WO disclosed
US-5986106-A Process for preparing 4-substituted-1H-indole-3-glyoxamides ELI LILLY AND COMPANY (US) 1999-11-16 US disclosed
WO-1999000360-A1 PROCESS FOR PREPARING 4-SUBSTITUTED-1H-INDOLE-3-GLYOXAMIDES ELI LILLY AND COMPANY (US) 1999-01-07 WO disclosed
EP-0887342-A2 Process for preparing 4-substituted-1H-indole-3-glyoxamides ELI LILLY AND COMPANY (US) 1998-12-30 EP 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 (1 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-20220378923-A1 BET DEGRADER BET1, BRD4, BICRA ALDH1A1 3226/4885MAPT 1478/4885L3MBTL1 1929/4885

“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.