SCHEMBL258201

SCHEMBL258201

COc1cc(NC(C)=O)ccc1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.58
ALDH1A1 P00352 2/20 0.58
CSNK2A2 P19784 1/20 0.57
CSNK2B P67870 1/20 0.57
CSNK2A1 P68400 1/20 0.57
NOX4 Q9NPH5 1/20 0.55
CES2 O00748 1/20 0.55
SLC22A6 Q4U2R8 1/20 0.53
SLC22A8 Q8TCC7 1/20 0.53
MEN1 O00255 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53
HTT P42858 2/20 0.52
MAPK1 P28482 2/20 0.52
LMNA P02545 1/20 0.52
ALOX15 P16050 1/20 0.52
TRPV1 Q8NER1 1/20 0.52
PKM P14618 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
FYN P06241 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
SCHEMBL30675560 1.00 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1CSNK2A2CSNK2BCSNK2A1
SCHEMBL4687827 0.86 HTT (0.56) SMN1; SMN2ALDH1A1CSNK2A2CSNK2BCSNK2A1
SCHEMBL5726240 0.86 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1MEN1RAB9AKMT2A
SCHEMBL1851780 0.85 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1MEN1RAB9AKMT2A
SCHEMBL30492996 0.85 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1MEN1RAB9AKMT2A
SCHEMBL27295012 0.84 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1CSNK2A2CSNK2BCSNK2A1
SCHEMBL6381094 0.83 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1CSNK2A2CSNK2BCSNK2A1
SCHEMBL8348162 0.83 IMPDH2 (0.55) NOX4SLC22A6SLC22A8MEN1RAB9A
SCHEMBL9817876 0.82 GRM4 (0.58) SMN1; SMN2ALDH1A1MEN1KMT2AHTT
SCHEMBL8413542 0.81 RORC (0.66) SMN1; SMN2ALDH1A1MEN1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117202986-A Hydrogel encapsulation and method for producing same 国际香精香料公司 2023-12-08 CN disclosed
CN-116764558-A Microcapsule compositions stabilized with viscosity control agents 国际香料和香精公司 2023-09-19 CN disclosed
EP-3836799-A1 OBTAINING A VOLATILE FRACTION FROM JUICES OR ALCOHOLIC BEVERAGES Symrise AG (DE) 2021-06-23 EP disclosed
CN-112566507-A Obtaining volatile fraction from fruit and vegetable juice or alcoholic beverage 西姆莱斯有限公司 2021-03-26 CN disclosed
CN-112041176-A System and method for printing and drying flavors and fragrances 国际香料和香精公司 2020-12-04 CN disclosed
EP-3154967-B1 PROCESSES FOR MAKING ALKYLATED ARYLPIPERAZINE AND ALKYLATED ARYLPIPERIDINE COMPOUNDS INCLUDING NOVEL INTERMEDIATES JOHNSON MATTHEY PLC (GB) 2020-07-29 EP disclosed
US-10695272-B2 Compositions containing microcapsules coated with deposition proteins INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2020-06-30 US disclosed
CN-107490640-B Method capable of simultaneously detecting acetaminophen and 8 plasma metabolites thereof 华润三九(枣庄)药业有限公司 2020-06-12 CN disclosed
WO-2020035147-A1 OBTAINING A VOLATILE FRACTION FROM JUICES OR ALCOHOLIC BEVERAGES SYMRISE AG (DE) 2020-02-20 WO disclosed
US-20180250204-A1 COMPOSITIONS CONTAINING MICROCAPSULES COATED WITH DEPOSITION PROTEINS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2018-09-06 US disclosed
US-20080242740-A1 AROMA COMPOSITIONS OF ALKAMIDES WITH HESPERETIN AND/OR 4-HYDROXYDIHYDROCHALCONES AND SALTS THEREOF FOR ENHANCING SWEET SENSORY IMPRESSIONS SYMRISE GMBH & CO. KG (DE) 2008-10-02 US disclosed
US-20050234132-A1 Production of cis-pellitorin and use as a flavouring SYMRISE AG (DE) 2005-10-20 US disclosed
US-20040241312-A1 Use of 2E,4E-decadienoic acid isobutylamide for imparting a salivation inducing effect to a foodstuff, an oral hygiene preparation or a gourmet or snack preparation; preparation by amidating a dodecadienoate with isobutylamine SYMRISE AG (DE) 2004-12-02 US disclosed
CN-1181376-A Production of benzophenone derivatives TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-05-13 CN disclosed
EP-0839801-A2 Production of benzophenone derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-05-06 EP disclosed
US-4413006-A N-Aryl-N-phenoxy-alkyl-piperazine compounds useful in decreasing intracranial pressure TANABE SEIYAKU CO., LTD. (JP) 1983-11-01 US disclosed
EP-0034284-B1 PIPERAZINE DERIVATIVE, PROCESSES FOR PREPARING THE SAME AND THERAPEUTIC COMPOSITIONS CONTAINING IT Tanabe Seiyaku Co., Ltd. (JP) 1983-10-05 EP disclosed
EP-0034752-B1 PHENOXYALKANE DERIVATIVE AND PROCESSES FOR PREPARING SAME Tanabe Seiyaku Co., Ltd. (JP) 1983-06-08 EP disclosed
EP-0034752-A1 Phenoxyalkane derivative and processes for preparing same Tanabe Seiyaku Co., Ltd. (JP) 1981-09-02 EP disclosed
EP-0034284-A2 Piperazine derivative, processes for preparing the same and therapeutic compositions containing it Tanabe Seiyaku Co., Ltd. (JP) 1981-08-26 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-20050234132-A1 Production of cis-pellitorin and use as a flavouring NISCH, CYP8B1, DLAT SMN1; SMN2 4793/4885ALDH1A1 429/4885CSNK2A2 1279/4885
US-10695272-B2 Compositions containing microcapsules coated with deposition proteins SAAL1, AUP1, FABP5 SMN1; SMN2 2186/4885ALDH1A1 4547/4885CSNK2A2 1472/4885
US-20080242740-A1 AROMA COMPOSITIONS OF ALKAMIDES WITH HESPERETIN AND/OR 4-HYDROXYDIHYDROCHALCONES AND SALTS THEREOF FOR ENHANCING SWEET SENSORY IMPRESSIONS TAS2R5, TAS2R20, TAS2R40 SMN1; SMN2 4384/4885ALDH1A1 401/4885CSNK2A2 3814/4885
US-20180250204-A1 COMPOSITIONS CONTAINING MICROCAPSULES COATED WITH DEPOSITION PROTEINS SAAL1, AUP1, FABP5 SMN1; SMN2 2186/4885ALDH1A1 4547/4885CSNK2A2 1472/4885

“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.