SCHEMBL4777286

SCHEMBL4777286

CCOC(=O)C=Cc1ccccc1Br

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.59
LY96 Q9Y6Y9 1/20 0.54
EGFR P00533 1/20 0.53
ERBB2 P04626 1/20 0.53
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
TTR P02766 1/20 0.48
DPP4 P27487 1/20 0.48
BCHE P06276 1/20 0.48
CYP3A4 P08684 2/20 0.46
CCNC P24863 1/20 0.46
CDK8 P49336 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MAPT P10636 3/20 0.46

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
SCHEMBL29608578 1.00 HSD11B1 (0.59) HSD11B1LY96EGFRERBB2CA12
SCHEMBL4777279 1.00 HSD11B1 (0.59) HSD11B1LY96EGFRERBB2CA12
SCHEMBL18416811 0.89 CA12 (0.50) HSD11B1LY96EGFRERBB2CA12
SCHEMBL21792208 0.89 CA12 (0.50) HSD11B1LY96EGFRERBB2CA12
SCHEMBL10783189 0.88 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL11821113 0.88 CA12 (0.49) HSD11B1LY96EGFRERBB2CA12
SCHEMBL11054639 0.86 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL13091485 0.86 CA12 (0.51) HSD11B1EGFRERBB2CA12CA1
SCHEMBL13324262 0.86 CA12 (0.51) HSD11B1EGFRERBB2CA12CA1
SCHEMBL18198103 0.85 CA12 (0.47) HSD11B1LY96EGFRERBB2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112679494-B Preparation method of pyrazolo [1,5-a ] pyridine derivative 贵州民族大学 2023-05-16 CN claimed
CN-113087652-A Improved preparation method of perindopril starting material indole-2-formic acid 宣城美诺华药业有限公司 2021-07-09 CN claimed
US-12459942-B2 Inhibiting (α-v)(β-6) integrin MORPHIC THERAPEUTIC, INC. (US) 2025-11-04 US disclosed
US-20240376095-A1 INHIBITING (ALPHA-V)(BETA-6) INTEGRIN SCHR¿DINGER, LLC 2024-11-14 US disclosed
CN-118878533-A Inhibition of αvβ6 integrin 莫菲克医疗股份有限公司 2024-11-01 CN disclosed
CN-112805001-B Inhibition of αvβ6 integrin 莫菲克医疗股份有限公司 2024-07-23 CN disclosed
CN-116969904-A Compounds useful as autophagy modulators, methods of preparation and uses thereof 微境生物医药科技(上海)有限公司 2023-10-31 CN disclosed
EP-3632903-B1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF WIGEN BIOMEDICINE TECH SHANGHAI CO LTD (CN) 2023-10-11 EP disclosed
US-11739087-B2 Inhibiting (α-v)(β-6) integrin MORPHIC THERAPEUTIC, INC. (US) 2023-08-29 US disclosed
CN-111148740-B Compounds useful as autophagy modulators, methods of preparation and uses thereof 微境生物医药科技(上海)有限公司 2023-08-25 CN disclosed
CN-112679494-B Preparation method of pyrazolo [1,5-a ] pyridine derivative 贵州民族大学 2023-05-16 CN disclosed
US-6627656-B2 Antagonists of the pain and inflammatory effects of E-type prostaglandins administered alone or in combination with analgesics, antipyretics, NSAIDs, antitussives, decongestants etc MERCK FROSST CANADA LTD. (CA) 2003-09-30 US disclosed
EP-1278734-A2 METHOD OF TREATMENT USING PHENYL AND BIARYL DERIVATIVES AS PROSTAGLANDIN E INHIBITORS AND COMPOUNDS USEFUL THEREFORE Merck Frosst Canada & Co. (CA) 2003-01-29 EP disclosed
US-20020082266-A1 Method of treatment using phenyl and biaryl derivatives as prostaglandin E inhibitors and compounds useful therefore MERCK FROSST CANADA LTD. (CA) 2002-06-27 US disclosed
WO-2001081312-A2 METHOD OF TREATMENT USING PHENYL AND BIARYL DERIVATIVES AS PROSTAGLANDIN E INHIBITORS AND COMPOUNDS USEFUL THEREFORE MERCK FROSST CANADA & CO. (CA) 2001-11-01 WO disclosed
EP-0143952-B1 SUBSTITUTED CINNAMYL-2,3-DIHYDROBENZOPYRANS AND CINNAMYLPHENOLS USEFUL AS ANTI-INFLAMMATORY AGENTS MERCK & CO. INC. (US) 1993-01-13 EP disclosed
US-4778818-A VISION AND SKIN DISORDERS MERCK & CO., INC. (US) 1988-10-18 US disclosed
US-4686235-A TOPICAL MERCK & CO., INC. (US) 1987-08-11 US disclosed
US-4537903-A Substituted cinnamyl-2,3-dihydrobenzofuran and analogs useful as anti-inflammatory agents MERCK & CO., INC. (US) 1985-08-27 US disclosed
EP-0143952-A1 Substituted cinnamyl-2,3-dihydrobenzopyrans and cinnamylphenols useful as anti-inflammatory agents MERCK & CO. INC. (US) 1985-06-12 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-12459942-B2 Inhibiting (α-v)(β-6) integrin ITGB6, ITGA6, ITGAV HSD11B1 4031/4885LY96 477/4885EGFR 1655/4885
US-20240376095-A1 INHIBITING (ALPHA-V)(BETA-6) INTEGRIN ITGB6, ITGA6, ITGAV HSD11B1 3511/4885LY96 447/4885EGFR 1960/4885
US-11739087-B2 Inhibiting (α-v)(β-6) integrin ITGB6, ITGA6, ITGAV HSD11B1 4031/4885LY96 477/4885EGFR 1655/4885
US-20020082266-A1 Method of treatment using phenyl and biaryl derivatives as prostaglandin E inhibitors and compounds useful therefore PTGER1, PTGS1, PTGES HSD11B1 187/4885LY96 1938/4885EGFR 4047/4885

“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.