SCHEMBL4422653

SCHEMBL4422653

O=C(O)c1[nH]c2cc(Cl)cc(Cl)c2c1/C=C1\CCN(c2ccccc2)C1=O.[NaH]

nearest known ligand 0.82

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 1/20 0.58
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
MAPK1 P28482 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
KMT2A Q03164 1/20 0.50
GPR17 Q13304 1/20 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
SCHEMBL4422661 1.00 GRIN1 (0.58) GRIN1MEN1LMNACYP1A2MAPK1
SCHEMBL499308 0.99 GRIN1 (0.59) GRIN1MEN1LMNACYP1A2MAPK1
SCHEMBL499309 0.99 GRIN1 (0.59) GRIN1MEN1LMNACYP1A2MAPK1
SCHEMBL8181067 0.94 GRIN1 (0.54) GRIN1MEN1LMNACYP1A2MAPK1
SCHEMBL8190768 0.93 GRIN1 (0.55) GRIN1MEN1LMNACYP1A2MAPK1
SCHEMBL8190756 0.93 GRIN1 (0.55) GRIN1MEN1LMNACYP1A2MAPK1
SCHEMBL8181079 0.92 GRIN1 (0.54) GRIN1MEN1LMNACYP1A2MAPK1
SCHEMBL1720270 0.90 GRIN1 (0.52) GRIN1MEN1LMNACYP1A2MAPK1
SCHEMBL30521938 0.90 GRIN1 (0.52) GRIN1MEN1LMNACYP1A2MAPK1
SCHEMBL8181069 0.85 MEN1 (0.49) GRIN1MEN1LMNACYP1A2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5962496-A CENTRAL NERVOUS SYSTEM DISORDERS GLAXO WELLCOME SPA (IT) 1999-10-05 US claimed
US-5760059-A ANTAGONISTS OF EXCITATORY AMINO ACIDS, TREATMENT OF NEURODEGENERATIVE DISEASES GLAXO WELLCOME SPA (IT) 1998-06-02 US claimed
US-20240156853-A1 IN VITRO AND IN VIVO INTRACELLULAR DELIVERY OF SIRNA VIA SELF-ASSEMBLED NANOPIECES RHODE ISLAND HOSPITAL 2024-05-16 US disclosed
US-11701379-B2 In vitro and in vivo intracellular delivery of siRNA via self-assembled nanopieces RHODE ISLAND HOSPITAL (US) 2023-07-18 US disclosed
US-11147799-B2 Topical pharmaceutical composition containing phenytoin and a (co-) analgesic for the treatment of chronic pain Keppel Hesselink, Jan Marius (NL) 2021-10-19 US disclosed
CN-106793970-B Nanoparring agents for diagnosis and therapy and processing thereof 罗得岛医院 2021-07-30 CN disclosed
US-20210023117-A1 IN VITRO AND IN VIVO INTRACELLULAR DELIVERY OF SIRNA VIA SELF-ASSEMBLED NANOPIECES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-01-28 US disclosed
US-20200375991-A1 NANOCARRIERS AND THEIR PROCESSING FOR DIAGNOSTICS AND THERAPEUTICS RHODE ISLAND HOSPITAL 2020-12-03 US disclosed
US-20200069649-A1 TOPICAL PHARMACEUTICAL COMPOSITION CONTAINING PHENYTOIN AND A (CO -) ANALGESIC FOR THE TREATMENT OF CHRONIC PAIN TOPICAL INNOVATIONS B.V. (NL) 2020-03-05 US disclosed
US-10555948-B2 Nanocarriers and their processing for diagnostics and therapeutics RHODE ISLAND HOSPITAL (US) 2020-02-11 US disclosed
EP-3551182-A1 TOPICAL PHARMACEUTICAL COMPOSITION CONTAINING PHENYTOIN AND A (CO -)AN ALGESIC FOR THE TREATMENT OF CHRONIC PAIN TOPICAL INNOVATIONS B.V. (NL) 2019-10-16 EP disclosed
WO-2006079055-A2 APPARATUS AND METHOD FOR DELIVERING THERAPEUTIC AND/OR OTHER AGENTS TO THE INNER EAR AND TO OTHER TISSUES NEUROSYSTEC CORPORATION (US) 2006-07-27 WO disclosed
US-6239287-B1 REACTING THE CORRESPONDING BROMO COMPOUND WITH A PHOSPHINE GLAXO WELLCOME SPA (IT) 2001-05-29 US disclosed
US-6100289-A ADMINISTERING AN ANALGESIC AMOUNT OF EXCITATORY AMINO ACID ANTAGONIST TO MAMMAL GLAXO WELLCOME SPA (IT) 2000-08-08 US disclosed
EP-0966463-A1 CRYSTALLINE HYDRATED SODIUM SALT OF (E)-4,6-DICHLORO-3-(2-OXO-1-PHENYLPYRROLIDIN-3-YLIDENE METHYL)-1H-INDOLE-2-CARBOXYLIC ACID GLAXO WELLCOME S.p.A. (IT) 1999-12-29 EP disclosed
EP-0966475-A1 PREPARATION OF PHOSPHONIUM COMPOUNDS AS INTERMEDIATES FOR GLYCINE ANTAGONISTS GLAXO WELLCOME S.p.A. (IT) 1999-12-29 EP disclosed
US-5962496-A CENTRAL NERVOUS SYSTEM DISORDERS GLAXO WELLCOME SPA (IT) 1999-10-05 US disclosed
WO-1998039327-A1 CRYSTALLINE HYDRATED SODIUM SALT OF (E)-4,6-DICHLORO-3-(2-OXO-1-PHENYLPYRROLIDIN-3-YLIDENE METHYL)-1H-INDOLE-2-CARBOXYLIC ACID GLAXO WELLCOME S.P.A. (IT) 1998-09-11 WO disclosed
WO-1998039341-A1 PREPARATION OF PHOSPHONIUM COMPOUNDS AS INTERMEDIATES FOR GLYCINE ANTAGONISTS GLAXO WELLCOME S.P.A. (IT) 1998-09-11 WO disclosed
US-5760059-A ANTAGONISTS OF EXCITATORY AMINO ACIDS, TREATMENT OF NEURODEGENERATIVE DISEASES GLAXO WELLCOME SPA (IT) 1998-06-02 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 (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-11701379-B2 In vitro and in vivo intracellular delivery of siRNA via self-assembled nanopieces NFATC1, TRAF6, UACA GRIN1 2951/4885MEN1 3021/4885LMNA 415/4885
US-20210023117-A1 IN VITRO AND IN VIVO INTRACELLULAR DELIVERY OF SIRNA VIA SELF-ASSEMBLED NANOPIECES NFATC1, TRAF6, UACA GRIN1 2951/4885MEN1 3021/4885LMNA 415/4885
US-10555948-B2 Nanocarriers and their processing for diagnostics and therapeutics SYVN1, SSB, TNF GRIN1 4102/4885MEN1 3527/4885LMNA 379/4885
US-20200375991-A1 NANOCARRIERS AND THEIR PROCESSING FOR DIAGNOSTICS AND THERAPEUTICS SYVN1, SSB, TNF GRIN1 4102/4885MEN1 3527/4885LMNA 379/4885
US-20240156853-A1 IN VITRO AND IN VIVO INTRACELLULAR DELIVERY OF SIRNA VIA SELF-ASSEMBLED NANOPIECES NFATC1, TRAF6, UACA GRIN1 2951/4885MEN1 3021/4885LMNA 415/4885

“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.