SCHEMBL8515013

SCHEMBL8515013

CCC[C@H]1CCC(=C2C(=O)CCC2=O)O1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.45
▸ SIRT2 Q8IXJ6 1/20 0.33
▸ TP53 P04637 1/20 0.32
▸ PPARG P37231 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL11881111 1.00 CYP1A2 (0.45) CYP1A2SIRT2TP53PPARGKMT2A
Potassium Ion SCHEMBL29744473 0.98 CYP1A2 (0.44) CYP1A2SIRT2TP53PPARGKMT2A
SCHEMBL891524 0.75 — —
SCHEMBL17831602 0.75 — —
SCHEMBL11872992 0.72 CYP1A2 (0.40) CYP1A2
SCHEMBL11876042 0.72 CYP1A2 (0.40) CYP1A2
SCHEMBL11871993 0.69 CYP1A2 (0.37) CYP1A2
SCHEMBL310717 0.68 CYP1A2 (0.58) CYP1A2SIRT2TP53PPARG
SCHEMBL13477018 0.68 CYP1A2 (0.58) CYP1A2SIRT2TP53PPARG
SCHEMBL30740436 0.68 TP53 (0.39) CYP1A2SIRT2TP53KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3618358-B1 A METHOD FOR DEEP PACKET INSPECTION IN SOFTWARE DEFINED NETWORKS ORCKIT IP LLC (US) 2024-05-29 — — EP claimed
US-20240024268-A1 Methods for Dopamine Modulation in Human Neurologic Diseases SACKNER BERNSTEIN JONATHAN (US) 2024-01-25 — — US claimed
US-11806326-B2 Methods for dopamine modulation in human neurologic diseases SACKNER BERNSTEIN JONATHAN (US) 2023-11-07 — — US claimed
US-20210052531-A1 Methods for Dopamine Modulation in Human Neurologic Diseases SACKNER BERNSTEIN JONATHAN (US) 2021-02-25 — — US claimed
EP-3749290-A1 METHODS FOR DOPAMINE MODULATION IN HUMAN NEUROLOGIC DISEASES Sackner-Bernstein, Jonathan (US) 2020-12-16 — — EP claimed
EP-3655036-A1 COMPOSITIONS FOR TREATING STRESS-RELATED DISORDERS Hoffman Technologies, Inc. (US) 2020-05-27 — — EP claimed
WO-2019147934-A1 METHODS FOR DOPAMINE MODULATION IN HUMAN NEUROLOGIC DISEASES SACKNER BERNSTEIN JONATHAN (US) 2019-08-01 — — WO claimed
WO-2019018633-A1 COMPOSITIONS FOR TREATING STRESS-RELATED DISORDERS HOFFMAN TECHNOLOGIES, INC. (US) 2019-01-24 — — WO claimed
US-20180243210-A1 METHOD FOR TREATING INTESTINAL FIBROSIS SIGMOID PHARMA LIMITED (IE) 2018-08-30 — — US claimed
EP-2642978-A2 IMMUNOMODULATORY COMPOSITIONS COMPRISING HYDRALAZINE FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS Sigmoid Pharma Limited (IE) 2013-10-02 — — EP claimed
WO-2012069658-A2 IMMUNOMODULATORY COMPOSITIONS SIGMOID PHARMA LIMITED (IE) 2012-05-31 — — WO claimed
US-12564622-B2 Preventing cytokine release syndrome THE JOHNS HOPKINS UNIVERSITY (US) 2026-03-03 — — US disclosed
EP-4079311-B1 NMN AND DERIVATIVES FOR USE IN THE TREATMENT OF DEPRESSION AND/OR ANXIETY IN PATIENTS HAVING A FORM OF PARKINSONISM NUVAMID SA (CH) 2025-10-01 — — EP disclosed
EP-4495238-A2 TARGETING EGLN1 IN CANCER The Broad Institute, Inc. (US) 2025-01-22 — — EP disclosed
US-20240417421-A1 NMN And Derivatives For Its Use In The Treatment Of Depression And/Or Anxiety In Patients Having A Form Of Parkinsonism NUVAMID SA (CH) 2024-12-19 — — US disclosed
US-5654152-A Method of measuring enzyme activity by using a column having an immobilized substrate SHOWA DENKO KABUSHIKI KAISHA (JP) 1997-08-05 — — US disclosed
EP-0329190-B1 Filler for measuring enzyme activity, column packed with the filler, and method of measuring enzyme activity using the column SHOWA DENKO KK (JP) 1995-09-13 — — EP disclosed
EP-0329190-A2 Filler for measuring enzyme activity, column packed with the filler, and method of measuring enzyme activity using the column SHOWA DENKO KABUSHIKI KAISHA (JP) 1989-08-23 — — EP disclosed
US-3835170-A HYPOTENSIVE AGENT, OUDENONE, ITS SALTS AND PROCESSES FOR PRODUCTION AND PREPARATION THEREOF MICROBIAL CHEM RES FOUND 1974-09-10 — — US disclosed
US-3835170-A HYPOTENSIVE AGENT, OUDENONE, ITS SALTS AND PROCESSES FOR PRODUCTION AND PREPARATION THEREOF MICROBIAL CHEM RES FOUND 1974-09-10 — — US 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 (2 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-12564622-B2 Preventing cytokine release syndrome CRH, IL1B, IL1A CYP1A2 1254/4885SIRT2 3929/4885TP53 4235/4885
US-20240417421-A1 NMN And Derivatives For Its Use In The Treatment Of Depression And/Or Anxiety In Patients Having A Form Of Parkinsonism SNCA, NLN, PARK7 CYP1A2 3123/4885SIRT2 1574/4885TP53 4062/4885

“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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