SCHEMBL960307

SCHEMBL960307

NNCc1ccc(O)c(O)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ ESR1 P03372 1/20 0.47
▸ ADORA3 P0DMS8 1/20 0.47
▸ NPY1R P25929 1/20 0.47
▸ PTGS2 P35354 1/20 0.47
▸ OPRD1 P41143 1/20 0.47
▸ MTOR P42345 1/20 0.47
▸ HK2 P52789 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ THPO P40225 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ ALPI P09923 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ MAPT P10636 1/20 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
SCHEMBL31174385 1.00 ESR2 (0.47) ESR2KDM4EALDH1A1ESR1ADORA3
Hydrochloric Acid SCHEMBL2442635 0.98 KDM4E (0.49) ESR2KDM4EALDH1A1ESR1ADORA3
SCHEMBL15307765 0.77 MAOB (0.47) ESR2KDM4EALDH1A1ESR1ADORA3
SCHEMBL633722 0.73 ESR2 (0.40) ESR2KDM4EALDH1A1ESR1ADORA3
SCHEMBL35864 0.72 HSPA5 (0.43) CYP3A4CYP2C9MEN1LMNAMAPT
SCHEMBL29368767 0.72 HSPA5 (0.43) CYP3A4CYP2C9MEN1LMNAMAPT
Hydrochloric Acid SCHEMBL3572840 0.71 KDM4E (0.41) ESR2KDM4EALDH1A1ESR1ADORA3
SCHEMBL23067398 0.71 AOC2 (0.41) ESR2KDM4EALDH1A1ESR1ADORA3
SCHEMBL28475321 0.71 SELL (0.45) —
SCHEMBL5458032 0.71 TYR (0.58) KDM4EALDH1A1CYP3A4MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12527754-B2 Methods and compositions for preventing and treating metabolic syndrome induced by antipsychotic treatment and related diseases and conditions TUFTS MEDICAL CENTER, INC. (US) 2026-01-20 — — US claimed
CN-118858482-A Method for simultaneously detecting blood concentration of levodopa, benserazide and 2,3, 4-trihydroxybenzylhydrazine 天津汉一医药科技有限公司 2024-10-29 — — CN claimed
CN-117142978-A Preparation method of benserazide hydrochloride and application of benserazide hydrochloride in composition 重庆圣华曦药业股份有限公司 2023-12-01 — — CN claimed
CN-116271044-A Application of inhibiting cystathionine beta synthase in immunotherapy 同济大学 2023-06-23 — — CN claimed
US-20210220298-A1 METHODS AND COMPOSITIONS FOR PREVENTING AND TREATING METABOLIC SYNDROME INDUCED BY ANTIPSYCHOTIC TREATMENT AND RELATED DISEASES AND CONDITIONS TUFTS MEDICAL CENTER, INC. 2021-07-22 — — US claimed
EP-3101001-B1 DEUTERATED CATECHOLAMINE DERIVATIVES AND MEDICAMENTS COMPRISING SAID COMPOUNDS TEVA PHARMACEUTICALS INT GMBH (CH) 2020-04-01 — — EP claimed
US-20070082953-A1 Use of l-dopa, derivatives thereof and medicaments comprising said compounds for the prophylaxis of psychotic diseases BDD BEROLINA DRUG DEVELOPMENT GMBH (DE) 2007-04-12 — — US claimed
US-20040101523-A1 Renal-selective prodrugs for control of renal smpathetic nerve activity in the treatment of hypertension G.D. SEARLE & CO. 2004-05-27 — — US claimed
US-20030220521-A1 Renal-selective prodrugs for control of renal sympathetic nerve activity in the treatment of hypertension G.D. SEARLE & CO. 2003-11-27 — — US claimed
EP-0484437-A4 RENAL-SELECTIVE PRODRUGS FOR THE TREATMENT OF HYPERTENSION SEARLE & CO (US) 1994-06-01 — — EP claimed
EP-0484437-A1 RENAL-SELECTIVE PRODRUGS FOR THE TREATMENT OF HYPERTENSION G.D. Searle & Co. (US) 1992-05-13 — — EP claimed
WO-1992001667-A1 RENAL-SELECTIVE PRODRUGS FOR CONTROL OF RENAL SYMPATHETIC NERVE ACTIVITY IN THE TREATMENT OF HYPERTENSION G.D. SEARLE & CO. (US) 1992-02-06 — — WO claimed
WO-1991001724-A1 RENAL-SELECTIVE PRODRUGS FOR THE TREATMENT OF HYPERTENSION G.D. SEARLE & CO. (US) 1991-02-21 — — WO claimed
US-4424235-A Hydrodynamically balanced controlled release compositions containing L-dopa and a decarboxylase inhibitor HOFFMANN-LA ROCHE INC. (US) 1984-01-03 — — US claimed
US-12527754-B2 Methods and compositions for preventing and treating metabolic syndrome induced by antipsychotic treatment and related diseases and conditions TUFTS MEDICAL CENTER, INC. (US) 2026-01-20 — — US disclosed
CN-117142978-B Preparation method of benserazide hydrochloride and application of benserazide hydrochloride in composition 重庆圣华曦药业股份有限公司 2025-11-04 — — CN disclosed
CN-118858482-A Method for simultaneously detecting blood concentration of levodopa, benserazide and 2,3, 4-trihydroxybenzylhydrazine 天津汉一医药科技有限公司 2024-10-29 — — CN disclosed
WO-1991001724-A1 RENAL-SELECTIVE PRODRUGS FOR THE TREATMENT OF HYPERTENSION G.D. SEARLE & CO. (US) 1991-02-21 — — WO disclosed
US-4849408-A GLYCYLTRYPTOPHAN, ANTIDEPRESSANTS, SEDATIVES (501) FRESENIUS AG (DE) 1989-07-18 — — US disclosed
WO-1989001774-A1 PHARMACEUTICAL COMPOSITIONS SAAD AL DAMLUJI (GB) 1989-03-09 — — WO 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-12527754-B2 Methods and compositions for preventing and treating metabolic syndrome induced by antipsychotic treatment and related diseases and conditions GPR119, TPH1, LIPC ESR2 2873/4885KDM4E 1845/4885ALDH1A1 971/4885
US-20210220298-A1 METHODS AND COMPOSITIONS FOR PREVENTING AND TREATING METABOLIC SYNDROME INDUCED BY ANTIPSYCHOTIC TREATMENT AND RELATED DISEASES AND CONDITIONS GPR119, PC, NLN ESR2 2152/4885KDM4E 3272/4885ALDH1A1 1625/4885
US-20030220521-A1 Renal-selective prodrugs for control of renal sympathetic nerve activity in the treatment of hypertension GLS, APEH, GGH ESR2 4555/4885KDM4E 1203/4885ALDH1A1 100/4885
US-20040101523-A1 Renal-selective prodrugs for control of renal smpathetic nerve activity in the treatment of hypertension GLS, DBH, APEH ESR2 4614/4885KDM4E 935/4885ALDH1A1 114/4885

“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.

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