SCHEMBL1021081

SCHEMBL1021081

COC(=O)NCC1(C)CC(NC(=O)OC)CC(C)(C)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 1.00
TDP1 Q9NUW8 1/20 0.36
KCNA3 P22001 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
EPHX1 P07099 1/20 0.31
USP2 O75604 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL22627334 0.93 TSHR (0.86) TSHRTDP1KCNA3USP2ATM
SCHEMBL12394889 0.92 TSHR (0.84) TSHRTDP1EPHX1
SCHEMBL10044269 0.92 TSHR (0.84) TSHRTDP1L3MBTL1ALDH1A1
SCHEMBL15171908 0.92 TSHR (0.84) TSHRTDP1
SCHEMBL16684434 0.91 TSHR (0.84) TSHRTDP1KCNA3
SCHEMBL13631002 0.91 TSHR (0.84) TSHRTDP1OPRM1OPRL1
SCHEMBL10044232 0.91 TSHR (0.84) TSHRTDP1KCNA3OPRM1OPRL1
SCHEMBL13867711 0.90 TSHR (0.82) TSHRTDP1EPHX1
SCHEMBL22627154 0.90 TSHR (0.82) TSHRTDP1KCNA3USP2ATM
SCHEMBL17552150 0.89 TSHR (0.80) TSHRTDP1EPHX1ATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4431490-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUNDS, METHOD FOR PRODUCING CARBAMATE COMPOUNDS, METHOD FOR RECOVERING AMINE COMPOUNDS, AND ISOCYANATE COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2024-09-18 EP disclosed
US-20230167364-A1 METHOD FOR MANUFACTURING POLYMER DISPERSED LIQUID CRYSTAL DISPLAY ELEMENT, AND POLYMER DISPERSED LIQUID CRYSTAL DISPLAY ELEMENT DIC CORPORATION (JP) 2023-06-01 US disclosed
US-20230167364-A1 METHOD FOR MANUFACTURING POLYMER DISPERSED LIQUID CRYSTAL DISPLAY ELEMENT, AND POLYMER DISPERSED LIQUID CRYSTAL DISPLAY ELEMENT DIC CORPORATION (JP) 2023-06-01 US disclosed
WO-2023080257-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUNDS, METHOD FOR PRODUCING CARBAMATE COMPOUNDS, METHOD FOR RECOVERING AMINE COMPOUNDS, AND ISOCYANATE COMPOSITION 旭化成株式会社 2023-05-11 WO disclosed
EP-3838892-B1 METHOD FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2022-10-12 EP disclosed
US-11360342-B2 Light-scattering liquid crystal device DIC CORPORATION (JP) 2022-06-14 US disclosed
US-11278489-B2 Cosmetic composition for nails, method of using same, and cosmetic resin for nails MENICON CO., LTD. (JP) 2022-03-22 US disclosed
EP-3293173-B1 METHOD FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2021-07-28 EP disclosed
US-20210223586-A1 LIGHT-SCATTERING LIQUID CRYSTAL DEVICE DIC CORPORATION (JP) 2021-07-22 US disclosed
EP-3838892-A1 METHOD FOR PRODUCING ISOCYANATE Asahi Kasei Kabushiki Kaisha (JP) 2021-06-23 EP disclosed
EP-0323514-B1 PROCESS FOR PREPARING ISOCYANATE COMPOUNDS DAICEL CHEM (JP) 1994-07-13 EP disclosed
US-5326903-A Thermal decomposition of carbamate NIPPON SHOKUBAI CO., LTD. (JP) 1994-07-05 US disclosed
US-5284969-A Thermal decomposition of the corresponding carbamic acid esters BAYER AKTIENGESELLSCHAFT (DE) 1994-02-08 US disclosed
EP-0555628-A2 Process for preparing isocyanates NIPPON SHOKUBAI CO., LTD. (JP) 1993-08-18 EP disclosed
EP-0542106-A2 Process for the preparation of polyisocyanates BAYER AG (DE) 1993-05-19 EP disclosed
US-5138015-A Reacting dialkyl carbonate with diamine to give urethane, thermally decomposing into diisocyanate, coverting into polyurethane in presence of Lewis acid and/or protonic acid DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1992-08-11 US disclosed
EP-0477376-A1 PROCESS FOR PRODUCING POLYURETHANE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1992-04-01 EP disclosed
EP-0244620-B1 PROCESS FOR THE PREPARATION OF ISOPHORONE DIISOCYANATE FROM ISOPHORONE DICARBAMYL ESTERS USING HIGHLY SELECTIVE SNO2 OR CUO CATALYSTS AMERICAN CYANAMID COMPANY (US) 1991-03-13 EP disclosed
EP-0323514-A1 PROCESS FOR PREPARING ISOCYANATE COMPOUNDS DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1989-07-12 EP disclosed
EP-0244620-A1 Process for the preparation of isophorone diisocyanate from isophorone dicarbamyl esters using highly selective SnO2 or CuO catalysts AMERICAN CYANAMID COMPANY (US) 1987-11-11 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-11278489-B2 Cosmetic composition for nails, method of using same, and cosmetic resin for nails POLR1C, NACA, PIK3C3 TSHR 2976/4885TDP1 2300/4885KCNA3 1321/4885

“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.