SCHEMBL417349

SCHEMBL417349

Cc1ccc2c(Cl)c(C(=O)O)sc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 1.00
BCL2L1 Q07817 1/20 1.00
BCKDK O14874 2/20 0.71
RXFP1 Q9HBX9 2/20 0.71
NPC1 O15118 6/20 0.65
RAB9A P51151 6/20 0.65
MAPT P10636 5/20 0.65
LMNA P02545 2/20 0.65
GAA P10253 1/20 0.65
SMN1; SMN2 Q16637 4/20 0.59
NPSR1 Q6W5P4 2/20 0.56
PPARG P37231 1/20 0.56
NR2E3 Q9Y5X4 1/20 0.56
NCOR2 Q9Y618 1/20 0.56
PKM P14618 1/20 0.54
RPA1 P27694 2/20 0.54
OPRM1 P35372 2/20 0.53
TBXAS1 P24557 1/20 0.52
F10 P00742 1/20 0.51
HPGD P15428 1/20 0.51

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
Hydrochloric Acid SCHEMBL11398368 0.98 MCL1 (0.97) MCL1BCL2L1BCKDKRXFP1NPC1
SCHEMBL17173224 0.88 MCL1 (0.79) MCL1BCL2L1BCKDKRXFP1NPC1
SCHEMBL415459 0.87 MCL1 (0.77) MCL1BCL2L1BCKDKRXFP1NPC1
SCHEMBL5023231 0.87 MCL1 (0.77) MCL1BCL2L1BCKDKRXFP1NPC1
SCHEMBL9178739 0.85 MCL1 (0.74) MCL1BCL2L1BCKDKRXFP1NPC1
SCHEMBL26267893 0.83 MCL1 (0.71) MCL1BCL2L1BCKDKRXFP1NPC1
SCHEMBL15619574 0.83 MCL1 (0.71) MCL1BCL2L1BCKDKRXFP1NPC1
SCHEMBL6886010 0.83 MCL1 (1.00) MCL1BCL2L1BCKDKRXFP1NPC1
SCHEMBL13819863 0.83 MCL1 (0.70) MCL1BCL2L1BCKDKRXFP1NPC1
SCHEMBL13659630 0.83 MCL1 (0.70) MCL1BCL2L1BCKDKRXFP1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114409663-B Zinc phthalocyanine 3-chloro-6 methylbenzo [ b ] thiophene-2-carboxylic acid conjugates targeting Mcl-1 enzyme and methods of making the same 福州大学 2023-05-30 CN claimed
CN-114409663-A Mcl-1 enzyme targeted zinc phthalocyanine 3-chloro-6 methylbenzo [ b ] thiophene-2-carboxylic acid conjugates and methods of making the same 福州大学 2022-04-29 CN claimed
US-8431684-B2 Process for the preparation of ibodutant (MEN15596) and related intermediates MALESCI ISTITUTO FARMACOBIOLOGICO S.P.A. (IT) 2013-04-30 US claimed
EP-2432778-B1 PROCESS FOR THE PREPARATION OF IBODUTANT (MEN15596) AND RELATED INTERMEDIATES MALESCI SAS (IT) 2013-03-20 EP claimed
EP-2432778-A1 PROCESS FOR THE PREPARATION OF IBODUTANT (MEN15596) AND RELATED INTERMEDIATES Malesci Istituto Farmacobiologico S.p.a. (IT) 2012-03-28 EP claimed
US-20120065370-A1 PROCESS FOR THE PREPARATION OF IBODUTANT (MEN15596) AND RELATED INTERMEDIATES MALESCI ISTITUTO FARMACOBIOLOGICO S.P.A. (IT) 2012-03-15 US claimed
WO-2010133306-A1 PROCESS FOR THE PREPARATION OF IBODUTANT (MEN15596) AND RELATED INTERMEDIATES MALESCI ISTITUTO FARMACOBIOLOGICO S.P.A. (IT) 2010-11-25 WO claimed
US-20250346575-A1 ISOINDOLINONE DERIVATIVE HAVING GLUTARIMIDE MOTHER NUCLEUS, AND USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2025-11-13 US disclosed
EP-4431505-A1 ISOINDOLINONE DERIVATIVE HAVING GLUTARIMIDE MOTHER NUCLEUS, AND USE THEREOF Korea Research Institute of Chemical Technology (KR) 2024-09-18 EP disclosed
CN-118234721-A Isoindolinone derivative with glutarimide mother nucleus and application thereof 韩国化学研究院 2024-06-21 CN disclosed
CN-114409663-B Zinc phthalocyanine 3-chloro-6 methylbenzo [ b ] thiophene-2-carboxylic acid conjugates targeting Mcl-1 enzyme and methods of making the same 福州大学 2023-05-30 CN disclosed
CN-114409663-B Zinc phthalocyanine 3-chloro-6 methylbenzo [ b ] thiophene-2-carboxylic acid conjugates targeting Mcl-1 enzyme and methods of making the same 福州大学 2023-05-30 CN disclosed
CN-114409663-B Zinc phthalocyanine 3-chloro-6 methylbenzo [ b ] thiophene-2-carboxylic acid conjugates targeting Mcl-1 enzyme and methods of making the same 福州大学 2023-05-30 CN disclosed
EP-1797065-A4 ACYCLIC 1,3-DIAMINES AND USES THEREFOR SMITHKLINE BEECHAM CORP (US) 2009-03-04 EP disclosed
EP-1891951-A1 Viral polymerase inhibitors BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2008-02-27 EP disclosed
EP-1414797-B1 HEPATITIS C VIRUS POLYMERASE INHIBITORS WITH A HETEROBICYLIC STRUCTURE BOEHRINGER INGELHEIM CA LTD (CA) 2008-01-02 EP disclosed
US-20070259965-A1 Acyclic 1,3-Diamine And Uses Therefor SMITHKLINE BEECHAM CORPORATION 2007-11-08 US disclosed
EP-1797065-A2 ACYCLIC 1,3-DIAMINES AND USES THEREFOR SMITHKLINE BEECHAM CORPORATION (US) 2007-06-20 EP disclosed
WO-2007016784-A1 NOVEL SUBSTITUTED 1,2,3-TΠAZOLYLMETHYL-BENZOTHIOPHENE OR -INDOLE AND THEIR USE AS LEUKOTΠENE BIOSYNTHESIS INHIBITORS MERCK FROSST CANADA LTD. (CA) 2007-02-15 WO disclosed
WO-2006029210-A2 ACYCLIC 1,3-DIAMINES AND USES THEREFOR SMITHKLINE BEECHAM CORPORATION (US) 2006-03-16 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 (3 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-20120065370-A1 PROCESS FOR THE PREPARATION OF IBODUTANT (MEN15596) AND RELATED INTERMEDIATES DDT, BBOX1, IMPDH2 MCL1 2699/4885BCL2L1 4430/4885BCKDK 736/4885
US-20070259965-A1 Acyclic 1,3-Diamine And Uses Therefor TRPV4, TRPC4, TRPV1 MCL1 4289/4885BCL2L1 2013/4885BCKDK 1865/4885
US-20250346575-A1 ISOINDOLINONE DERIVATIVE HAVING GLUTARIMIDE MOTHER NUCLEUS, AND USE THEREOF CRBN, IDH1, IDH2 MCL1 121/4885BCL2L1 842/4885BCKDK 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.