SCHEMBL57137

SCHEMBL57137

COc1ccc([C@@H](C)N)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C19 P33261 1/20 0.55
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA12 O43570 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
SLC6A4 P31645 2/20 0.54
ADRB2 P07550 1/20 0.52
TDP1 Q9NUW8 3/20 0.50
MAPK1 P28482 2/20 0.50
ALDH1A1 P00352 2/20 0.50
ACHE P22303 2/20 0.50
TSHR P16473 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SLC6A3 Q01959 1/20 0.48
MAOA P21397 2/20 0.48
MAOB P27338 2/20 0.48

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
SCHEMBL56478 1.00 CYP1A2 (0.55) CYP1A2CYP2D6CYP2C19CA1CA2
SCHEMBL120603 1.00 CYP1A2 (0.55) CYP1A2CYP2D6CYP2C19CA1CA2
Hydrochloric Acid SCHEMBL28704563 0.98 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C19CA1CA2
Bromide SCHEMBL28602504 0.98 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C19CA1CA2
Hydrochloric Acid SCHEMBL2186508 0.98 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C19CA1CA2
Hydrochloric Acid SCHEMBL28706049 0.98 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C19CA1CA2
SCHEMBL756642 0.93 LTA4H (0.52) CYP1A2CYP2D6CYP2C19CA1CA2
SCHEMBL30913870 0.93 ALOX5 (0.53) CYP1A2CYP2D6CYP2C19CA1CA2
Propane SCHEMBL29187532 0.93 CYP1A2 (0.55) CYP1A2CYP2D6CYP2C19CA1CA2
Acetic Acid SCHEMBL11035019 0.88 ALOX5 (0.49) CYP1A2CYP2D6CYP2C19CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250078176-A1 ENVIRONMENTAL ATTRIBUTES FOR NITROGEN CONTAINING CHEMICALS BASF SE (DE) 2025-03-06 US claimed
US-20240327419-A1 SYNTHESIS OF SUBSTITUTED TRICYCLIC AMIDES AND ANALOGUES THEREOF ARBUTUS BIOPHARMA CORP (CA) 2024-10-03 US claimed
EP-4373823-A1 SYNTHESIS OF SUBSTITUTED TRICYCLIC AMIDES AND ANALOGUES THEREOF Arbutus Biopharma Corporation (CA) 2024-05-29 EP claimed
CN-117730082-A Synthesis of substituted tricyclic amides and analogs thereof 爱彼特生物制药公司 2024-03-19 CN claimed
WO-2023117926-A1 ENVIRONMENTAL ATTRIBUTES FOR NITROGEN CONTAINING CHEMICALS BASF SE (DE) 2023-06-29 WO claimed
WO-2023002323-A1 SYNTHESIS OF SUBSTITUTED TRICYCLIC AMIDES AND ANALOGUES THEREOF ARBUTUS BIOPHARMA CORPORATION (CA) 2023-01-26 WO claimed
CN-115073373-A Method for asymmetric synthesis of (R) -5' -methoxy labdanin 广东嘉博制药有限公司 2022-09-20 CN claimed
CN-114561440-B Preparation method of high-purity (R) - (+) -1- (4-methoxyphenylethyl amine monomer 天津全和诚科技有限责任公司 2022-07-29 CN claimed
CN-114561440-A Preparation method of high-purity (R) - (+) -1- (4-methoxyphenylethyl amine monomer 天津全和诚科技有限责任公司 2022-05-31 CN claimed
CN-114163411-A Preparation method of enantiomer pure dihydromyricetin 宁波大学 2022-03-11 CN claimed
CN-109632921-B Detection method for content of levofloxacin in levofloxacin bulk drug, electrochemical sensor used in detection method and chiral pyrrole compound 嘉兴学院 2021-02-26 CN claimed
US-9458463-B2 Method for treatment of diabetes by a small molecule inhibitor for GRK5 MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2016-10-04 US claimed
US-8084630-B2 Process for the synthesis of ramelteon and its intermediates TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2011-12-27 US claimed
US-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-11-12 US claimed
EP-2098519-A1 Process for the synthesis of ramelteon and its intermediates Teva Pharmaceutical Industries Ltd. (IL) 2009-09-09 EP claimed
US-20090069581-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-03-12 US claimed
EP-4714953-A1 MELANOCORTIN 2-TYPE RECEPTOR ANTAGONIST Scohia Pharma, Inc. (JP) 2026-03-25 EP disclosed
EP-4695271-A2 A CYCLIC PEPTIDE FOR TRAPPING INTERLEUKIN-1 BETA Merck Sharp & Dohme LLC (US) 2026-02-18 EP disclosed
CN-1035827-A The 4-oxo of opticity-1-chromene-2-carboxylic acid derivative and intermediates preparation thereof SANWA KAGAKU KENKYUSHO K K (JP) 1989-09-27 CN disclosed
EP-0331078-A2 Process for the preparation of optically active 4-oxo-1-benzopyran-2-carboxylic acid derivatives and intermediates thereof SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1989-09-06 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 (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-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES CYP2B6, UGT1A6, CYP2A6 CYP1A2 5/4885CYP2D6 13/4885CYP2C19 76/4885
US-20240327419-A1 SYNTHESIS OF SUBSTITUTED TRICYCLIC AMIDES AND ANALOGUES THEREOF HCCS, HDGF, GLS2 CYP1A2 584/4885CYP2D6 324/4885CYP2C19 733/4885
US-20090069581-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES CYP2B6, UGT1A6, CYP2A6 CYP1A2 6/4885CYP2D6 4/4885CYP2C19 60/4885

“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.