SCHEMBL2116716

SCHEMBL2116716

O=C(N[C@H](C(=O)O)C(O)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.46
CTSS P25774 3/20 0.46
CTSB P07858 2/20 0.44
F2 P00734 1/20 0.44
F10 P00742 1/20 0.44
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
F7 P08709 1/20 0.44
F3 P13726 1/20 0.44
PRSS3 P35030 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
ACHE P22303 1/20 0.43
CTRB1 P17538 2/20 0.43
CTSK P43235 1/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL10039872 1.00 CTSL (0.46) CTSLCTSSCTSBF2F10
SCHEMBL7311447 1.00 CTSL (0.46) CTSLCTSSCTSBF2F10
SCHEMBL7309373 1.00 CTSL (0.46) CTSLCTSSCTSBF2F10
SCHEMBL10005610 1.00 CTSL (0.46) CTSLCTSSCTSBF2F10
Hydroxyamine SCHEMBL7320373 0.98 F2 (0.45) CTSLCTSSCTSBF2F10
Hydroxyamine SCHEMBL7320378 0.98 F2 (0.45) CTSLCTSSCTSBF2F10
SCHEMBL9501192 0.93 CTSL (0.46) CTSLCTSSCTSBCA1CA2
SCHEMBL10363640 0.91 TRPM8 (0.49) CTSLCTSSCTSBF2F10
SCHEMBL9501314 0.91 TRPM8 (0.49) CTSLCTSSCTSBF2F10
SCHEMBL18857458 0.89 CTSL (0.44) CTSLCTSSCTSBMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113307741-B Preparation method of droxidopa 东莞市东阳光仿制药研发有限公司 2024-05-14 CN disclosed
EP-3587393-B1 ENZYMATIC PROCESS FOR THE PREPARATION OF DROXIDOPA FIS FABBRICA ITALIANA SINTETICI SPA (IT) 2024-01-17 EP disclosed
CN-117305197-A Recombinant bacterium and application thereof in synthesis of L-threo-3, 4-dihydroxyphenyl serine 杭州唯铂莱生物科技有限公司 2023-12-29 CN disclosed
CN-110099893-B Preparation method of droxidopa and intermediate thereof 广东东阳光药业有限公司 2022-09-27 CN disclosed
US-11447443-B2 Process for the preparation of droxidopa and its intermediate PIRAMAL PHARMA LIMITED (IN) 2022-09-20 US disclosed
US-11434197-B2 Enzymatic process for the preparation of Droxidopa F.I.S.—Fabbrica Italiana Sintetici S.p.A. (IT) 2022-09-06 US disclosed
US-11192848-B2 Process for the preparation of droxidopa and its intermediate PIRAMAL PHARMA LIMITED (IN) 2021-12-07 US disclosed
US-20210163401-A1 ENZYMATIC PROCESS FOR THE PREPARATION OF DROXIDOPA F.I.S. - FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2021-06-03 US disclosed
US-20200354308-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF DROXIDOPA AND ITS INTERMEDIATE Piramal Enterprises Limited (IN) 2020-11-12 US disclosed
EP-3735403-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF DROXIDOPA AND ITS INTERMEDIATE Piramal Enterprises Limited (IN) 2020-11-11 EP disclosed
EP-0177356-B1 METHOD FOR TREATMENT OF ANTIDIURESIS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1991-09-18 EP disclosed
EP-0185814-B1 PHENYLSERINE DERIVATIVES AND PROCESSES FOR THEIR PREPARATION SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1990-08-29 EP disclosed
EP-0141613-B1 A PROCESS FOR PRODUCING AN OPTICALLY ACTIVE 3-(3,4-DIHYDROXPHENYL) SERINE AND A PROTECED DERIVATIVE THEREOF ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1989-02-01 EP disclosed
US-4699879-A ENZYMIC DEACYLATION ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1987-10-13 US disclosed
US-4695580-A Phenylserine derivatives and processes for preparing the same SUMITOMO PHARMACEUTICALS COMPANY, LTD. (JP) 1987-09-22 US disclosed
EP-0185814-A2 Phenylserine derivatives and processes for their preparation SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1986-07-02 EP disclosed
EP-0177356-A2 Method for treatment of antidiuresis SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1986-04-09 EP disclosed
EP-0141613-A2 A process for producing an optically active 3-(3,4-dihydroxphenyl) serine and a proteced derivative thereof ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1985-05-15 EP disclosed
US-4319040-A Process for the production of optically active threo-3-(3,4-dihydroxyphenyl)serine SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-03-09 US disclosed
EP-0024210-A1 Process for the production of optically active threo-3-(3,4-dihydroxyphenyl) serine, and product thus produced SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-02-25 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 (5 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-11192848-B2 Process for the preparation of droxidopa and its intermediate COMT, DRD2, DAO CTSL 1660/4885CTSS 1174/4885CTSB 1260/4885
US-20210163401-A1 ENZYMATIC PROCESS FOR THE PREPARATION OF DROXIDOPA COMT, CYP3A4, CYP1A2 CTSL 1149/4885CTSS 600/4885CTSB 490/4885
US-20200354308-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF DROXIDOPA AND ITS INTERMEDIATE DAO, COMT, DRD4 CTSL 1740/4885CTSS 1219/4885CTSB 1483/4885
US-11434197-B2 Enzymatic process for the preparation of Droxidopa COMT, CYP3A4, CYP1A2 CTSL 1149/4885CTSS 600/4885CTSB 490/4885
US-11447443-B2 Process for the preparation of droxidopa and its intermediate COMT, DAO, DRD4 CTSL 1401/4885CTSS 1393/4885CTSB 1581/4885

“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.