SCHEMBL630884

SCHEMBL630884

CC(C)(C)Oc1ccc(C[C@H](NC(=O)OCc2ccccc2)C(=O)O)cc1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 13/20 0.69
ITGA2B P08514 13/20 0.69
CTSL P07711 2/20 0.64
CTSK P43235 2/20 0.64
ITGAV P06756 1/20 0.57
CTSB P07858 1/20 0.56
CTSS P25774 1/20 0.56
ALDH1A1 P00352 1/20 0.55
ALOX15 P16050 1/20 0.55
TACR1 P25103 2/20 0.54

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
SCHEMBL630885 1.00 ITGB3 (0.69) ITGB3ITGA2BCTSLCTSKITGAV
SCHEMBL29400860 1.00 ITGB3 (0.69) ITGB3ITGA2BCTSLCTSKITGAV
SCHEMBL7620943 0.96 CTSL (0.66) ITGB3ITGA2BCTSLCTSKCTSB
SCHEMBL13919532 0.92 CTSL (0.63) ITGB3ITGA2BCTSLCTSKCTSB
SCHEMBL3359560 0.92 CTSL (0.63) ITGB3ITGA2BCTSLCTSKCTSB
SCHEMBL31326047 0.91 CTSK (0.61) ITGB3ITGA2BCTSLCTSK
SCHEMBL10349206 0.90 CTSL (0.64) ITGB3ITGA2BCTSLCTSKCTSB
SCHEMBL31530457 0.90 CTSL (0.59) ITGB3ITGA2BCTSLCTSK
SCHEMBL29401392 0.89 ITGB3 (0.58) ITGB3ITGA2BCTSLCTSKITGAV
SCHEMBL29787893 0.89 ITGB3 (0.58) ITGB3ITGA2BCTSLCTSKITGAV

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120004764-A Preparation method of amino acid tert-butyl ether 四川什邡市三高生化实业有限公司 2025-05-16 CN disclosed
US-12187668-B2 Compositions and methods for treating and preventing neurodegenerative disorders ALZHEON, INC. (US) 2025-01-07 US disclosed
CN-115053184-B Composition for forming EUV resist underlayer film 日产化学株式会社 2024-12-06 CN disclosed
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 EP disclosed
US-20240011979-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS INC. (KR) 2024-01-11 US disclosed
US-20230374020-A1 SUBSTITUTED IMIDAZO[l,2-a]PYRAZINES AND PYRAZINO[l,2-a] PYRIMIDINES AS TOPICAL AGENTS FOR DERMATOLOGICAL APPLICATIONS Genesis Molecular Technologies, Inc. 2023-11-23 US disclosed
US-20230374020-A1 SUBSTITUTED IMIDAZO[l,2-a]PYRAZINES AND PYRAZINO[l,2-a] PYRIMIDINES AS TOPICAL AGENTS FOR DERMATOLOGICAL APPLICATIONS Genesis Molecular Technologies, Inc. 2023-11-23 US disclosed
US-20230348476-A1 CBP/CATENIN SIGNALING PATHWAY INHIBITORS AND USES THEREOF 3 2 PHARMA LLC (US) 2023-11-02 US disclosed
EP-3334710-B1 COMPOSITIONS AND METHODS FOR TREATING AND PREVENTING NEURODEGENERATIVE DISORDERS ALZHEON INC (US) 2023-10-04 EP disclosed
US-11655253-B2 CBP/catenin signaling pathway inhibitors and uses thereof 3+2 PHARMA, LLC (US) 2023-05-23 US disclosed
US-5446161-A Protease inhibitor, viricides HOFFMANN-LA ROCHE INC. (US) 1995-08-29 US disclosed
EP-0643072-A1 2-Piperazinone compounds and their use Takeda Chemical Industries, Ltd. (JP) 1995-03-15 EP disclosed
EP-0533516-B1 Amides of 1-(alkoxybenzyl)piperazines, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1995-02-08 EP disclosed
EP-0611774-A1 Production of amides and peptides without racemization in the presence of catalytic amounts of a N-hydroxy-compound F. HOFFMANN-LA ROCHE AG (CH) 1994-08-24 EP disclosed
US-5340809-A Antihypoxic, antiischemic agents ADIR ET COMPAGNIE (FR) 1994-08-23 US disclosed
EP-0346847-B1 Amino acid derivatives HOFFMANN LA ROCHE (CH) 1994-05-11 EP disclosed
EP-0375058-B1 New retro-inverso analogues of trymopentin, the method for their synthesis and their use in the preparation of pharmaceutical compositions SCLAVO SPA (IT) 1994-03-16 EP disclosed
EP-0533516-A2 Amides of 1-(alkoxybenzyl)piperazines, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1993-03-24 EP disclosed
US-5157041-A Viricides HOFFMANN-LA ROCHE INC. (US) 1992-10-20 US disclosed
EP-0346847-A2 Amino acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1989-12-20 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 (4 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-20230348476-A1 CBP/CATENIN SIGNALING PATHWAY INHIBITORS AND USES THEREOF CREBBP, CREB1, EP300 ITGB3 2378/4885ITGA2B 2244/4885CTSL 3585/4885
US-11655253-B2 CBP/catenin signaling pathway inhibitors and uses thereof CREBBP, CREB1, EP300 ITGB3 2378/4885ITGA2B 2244/4885CTSL 3585/4885
US-12187668-B2 Compositions and methods for treating and preventing neurodegenerative disorders PSEN2, CLN6, PSEN1 ITGB3 4507/4885ITGA2B 4499/4885CTSL 1826/4885
US-20230374020-A1 SUBSTITUTED IMIDAZO[l,2-a]PYRAZINES AND PYRAZINO[l,2-a] PYRIMIDINES AS TOPICAL AGENTS FOR DERMATOLOGICAL APPLICATIONS CREBBP, CREB1, EP300 ITGB3 3601/4885ITGA2B 3258/4885CTSL 3408/4885

“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.