SCHEMBL897560

SCHEMBL897560

CCc1ccc(C(C)(C)C(=O)CC(=O)OC(C)(C)C)cc1I

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.40
MTNR1B P49286 4/20 0.40
CACNA1B Q00975 1/20 0.33
SLC6A3 Q01959 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PTPRC P08575 2/20 0.31
EGFR P00533 1/20 0.30

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
SCHEMBL28354748 0.89 SLC6A3 (0.35) MTNR1AMTNR1BSLC6A3ALDH1A1
SCHEMBL28351117 0.86 MGAM (0.37) KDM4EALDH1A1EGFR
SCHEMBL23639731 0.86 EPHX2 (0.36) MTNR1AMTNR1BCACNA1B
SCHEMBL28351162 0.86 MTNR1A (0.38) MTNR1AMTNR1BSLC6A3KDM4EALDH1A1
SCHEMBL31507377 0.85 MTOR (0.38) MTNR1AMTNR1BCACNA1BKDM4EALDH1A1
SCHEMBL19296748 0.83 ESR1 (0.33) MTNR1AMTNR1BSLC6A3
SCHEMBL17434660 0.83 ESR1 (0.34) SLC6A3ALDH1A1
SCHEMBL29962699 0.83 ESR1 (0.34) SLC6A3ALDH1A1
SCHEMBL897783 0.79 APP (0.41) ALDH1A1
SCHEMBL29660078 0.79 APP (0.41) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4321514-B1 COMPOUND HAVING ALK INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND USE THEREOF CGENETECH SUZHOU CHINA CO LTD (CN) 2025-12-03 EP disclosed
EP-3848361-B1 METHOD OF PRODUCING TETRACYCLIC COMPOUND CHUGAI PHARMACEUTICAL CO LTD (JP) 2025-01-22 EP disclosed
US-20240246927-A1 COMPOUNDS WITH ALK INHIBITORY ACTIVITY AND PREPARATION METHOD AND USE THEREOF CGENETECH (SUZHOU, CHINA) CO., LTD. (CN) 2024-07-25 US disclosed
CN-112585126-B Process for preparing tetracyclic compounds 中外制药株式会社 2024-05-07 CN disclosed
US-11939322-B2 Method for producing tetracyclic compound CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-03-26 US disclosed
EP-4321514-A1 COMPOUND HAVING ALK INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND USE THEREOF CGeneTech (Suzhou, China) Co., Ltd. (CN) 2024-02-14 EP disclosed
CN-115340523-B Compound with ALK inhibitory activity and preparation method and application thereof 盛世泰科生物医药技术(苏州)股份有限公司 2023-12-15 CN disclosed
US-20230142119-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-11 US disclosed
US-20220372025-A1 METHOD FOR PRODUCING TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-11-24 US disclosed
WO-2022237813-A1 COMPOUND HAVING ALK INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND USE THEREOF 盛世泰科生物医药技术(苏州)有限公司 2022-11-17 WO disclosed
US-9440922-B2 Tetracyclic compound CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-09-13 US disclosed
US-20160257667-A1 SYNTHESIS OF INTERMEDIATES IN THE PREPARATION OF ALK INHIBITOR XU YONG (US) 2016-09-08 US disclosed
US-20160257667-A1 SYNTHESIS OF INTERMEDIATES IN THE PREPARATION OF ALK INHIBITOR XU YONG (US) 2016-09-08 US disclosed
EP-2441753-B1 TETRACYCLIC COMPOUND CHUGAI PHARMACEUTICAL CO LTD (JP) 2016-03-30 EP disclosed
EP-2975024-A1 TETRACYCLIC COMPOUNDS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-01-20 EP disclosed
US-9126931-B2 Tetracyclic compound CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-09-08 US disclosed
US-20150150845-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-06-04 US disclosed
CN-102459172-A Tetracyclic compounds CHUGAI PHARMACEUTICAL CO LTD 2012-05-16 CN disclosed
EP-2441753-A1 TETRACYCLIC COMPOUND Chugai Seiyaku Kabushiki Kaisha (JP) 2012-04-18 EP disclosed
US-20120083488-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA 2012-04-05 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 (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-20220372025-A1 METHOD FOR PRODUCING TETRACYCLIC COMPOUND CYP1B1, CYP4B1, PAICS MTNR1A 3238/4885MTNR1B 715/4885CACNA1B 161/4885
US-20160257667-A1 SYNTHESIS OF INTERMEDIATES IN THE PREPARATION OF ALK INHIBITOR ALK, ACVR1B, ETV6 MTNR1A 4879/4885MTNR1B 4736/4885CACNA1B 2212/4885
US-20230142119-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 MTNR1A 4200/4885MTNR1B 3833/4885CACNA1B 249/4885
US-20120083488-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 MTNR1A 4200/4885MTNR1B 3833/4885CACNA1B 249/4885
US-20240246927-A1 COMPOUNDS WITH ALK INHIBITORY ACTIVITY AND PREPARATION METHOD AND USE THEREOF ALK, ACVR1, ALKBH3 MTNR1A 4308/4885MTNR1B 3757/4885CACNA1B 2759/4885
US-20150150845-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 MTNR1A 4200/4885MTNR1B 3833/4885CACNA1B 249/4885
US-11939322-B2 Method for producing tetracyclic compound CYP1B1, CYP4B1, PAICS MTNR1A 3238/4885MTNR1B 715/4885CACNA1B 161/4885

“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.