SCHEMBL2597018

SCHEMBL2597018

Cc1cc(C(C)(C)c2ccc(N3C(=O)C=CC3=O)c(C)c2)ccc1N1C(=O)C=CC1=O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 12/20 0.53
▸ ESR1 P03372 2/20 0.42
▸ TLR9 Q9NR96 2/20 0.42
▸ HSP90AA1 P07900 3/20 0.41
▸ HPGD P15428 2/20 0.41
▸ CCR6 P51684 2/20 0.41
▸ G6PD P11413 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ NLRP1 Q9C000 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ FAAH O00519 3/20 0.37
▸ ESR2 Q92731 1/20 0.37

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
SCHEMBL11094672 0.91 ESR1 (0.61) MGLLESR1TLR9HSP90AA1HPGD
SCHEMBL8735072 0.85 MGLL (0.42) MGLLTLR9HSP90AA1HPGDCCR6
SCHEMBL10489999 0.82 MGLL (0.50) MGLLTLR9HSP90AA1HPGDCCR6
SCHEMBL9578147 0.81 MGLL (0.49) MGLLESR1TLR9HSP90AA1HPGD
SCHEMBL21888605 0.79 ESR1 (0.48) MGLLESR1TLR9HSP90AA1HPGD
SCHEMBL29485049 0.79 MGLL (0.59) MGLLTLR9HSP90AA1HPGDCCR6
SCHEMBL717739 0.79 MGLL (0.59) MGLLTLR9HSP90AA1HPGDCCR6
SCHEMBL30104193 0.79 HPGD (0.63) MGLLESR1TLR9HSP90AA1HPGD
SCHEMBL3183796 0.79 HPGD (0.63) MGLLESR1TLR9HSP90AA1HPGD
SCHEMBL29898506 0.77 TLR9 (0.61) MGLLTLR9HSP90AA1CCR6G6PD

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
US-9884944-B2 Remendable interfaces for polymer composites DREXEL UNIVERSITY (US) 2018-02-06 — — US claimed
US-4503186-A PRINTED CIRCUITS, SOLVENT-RESISTANT THERMOPLASTIC MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1985-03-05 — — US claimed
US-4496695-A POLYPHENYLENE ETHER RESIN AN EPOXY COMPOUND, PLUS A MALEIMIDE AND OR CYANATE ESTER COMPONENT MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1985-01-29 — — US claimed
US-4404330-A ACRYLONITRILE-BUTADIENE COPOLYMER OR TERPOLYMER AND CYANATE ESTER COMPOUNDS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-09-13 — — US claimed
US-4403073-A MODIFIED POLYBUTADIENE AND ISOCYANATE ESTER; HEAT RESISTANCE; FLEXIBILITY; ELASTICITY MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-09-06 — — US claimed
US-4396745-A POLYFUNCTIONAL AROMATIC CYANATE, RUBBER MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-08-02 — — US claimed
US-4396679-A Plastic articles suitable for electroless plating MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-08-02 — — US claimed
US-4383903-A POLYFUNCTIONAL AROMATIC CYANATE, ACRYLIC COMPOUND, POLYFUNCTIONAL MALEIMIDE, PHOTOINITIATOR MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-05-17 — — US claimed
US-9884944-B2 Remendable interfaces for polymer composites DREXEL UNIVERSITY (US) 2018-02-06 — — US disclosed
US-20170324116-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE SOLUTION SECONDARY BATTERY USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2017-11-09 — — US disclosed
US-20170324116-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE SOLUTION SECONDARY BATTERY USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2017-11-09 — — US disclosed
US-20130059988-A1 REMENDABLE INTERFACES FOR POLYMER COMPOSITES DREXEL UNIVERSITY (US) 2013-03-07 — — US disclosed
WO-2011146577-A2 REMENDABLE INTERFACES FOR POLYMER COMPOSITES DREXEL UNIVERSITY (US) 2011-11-24 — — WO disclosed
US-4740343-A Method for producing rigid resin molds MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1988-04-26 — — US disclosed
US-4404330-A ACRYLONITRILE-BUTADIENE COPOLYMER OR TERPOLYMER AND CYANATE ESTER COMPOUNDS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-09-13 — — US disclosed
US-4403073-A MODIFIED POLYBUTADIENE AND ISOCYANATE ESTER; HEAT RESISTANCE; FLEXIBILITY; ELASTICITY MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-09-06 — — US disclosed
US-4396745-A POLYFUNCTIONAL AROMATIC CYANATE, RUBBER MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-08-02 — — US disclosed
US-4396679-A Plastic articles suitable for electroless plating MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-08-02 — — US disclosed
US-4383903-A POLYFUNCTIONAL AROMATIC CYANATE, ACRYLIC COMPOUND, POLYFUNCTIONAL MALEIMIDE, PHOTOINITIATOR MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-05-17 — — US disclosed
EP-0056473-A2 Colloidal solutions, processes for producing the same and uses thereof MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1982-07-28 — — 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 (1 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-20170324116-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE SOLUTION SECONDARY BATTERY USING THE SAME KCNN2, KCNE1, KCNN1 MGLL 2639/4885ESR1 754/4885TLR9 305/4885

“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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