SCHEMBL10033172

SCHEMBL10033172

N#COc1ccc(-c2ccc(N=C=O)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 3/20 0.42
▸ TSHR P16473 1/20 0.42
▸ TDP1 Q9NUW8 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ TRPA1 O75762 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ DRD1 P21728 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
SCHEMBL27444669 0.95 CYP3A4 (0.39) CYP3A4TSHRTDP1MAPK1TRPA1
SCHEMBL27444645 0.95 CYP3A4 (0.39) CYP3A4TSHRTDP1MAPK1TRPA1
SCHEMBL34741 0.94 CYP3A4 (0.47) CYP3A4TSHRTDP1MAPK1TRPA1
SCHEMBL25873097 0.91 CYP3A4 (0.61) CYP3A4TSHRTDP1MAPK1CYP1A2
SCHEMBL15981020 0.89 CYP3A4 (0.42) CYP3A4TSHRTDP1MAPK1TRPA1
SCHEMBL25873160 0.88 CYP3A4 (0.34) CYP3A4TSHRTRPA1
SCHEMBL25873163 0.88 CYP3A4 (0.34) CYP3A4TSHRTRPA1
SCHEMBL12603688 0.85 APP (0.33) CYP3A4TSHRTDP1CYP1A2ALDH1A1
SCHEMBL20045932 0.84 CYP3A4 (0.39) CYP3A4TSHRTDP1MAPK1TRPA1
SCHEMBL14826119 0.84 CYP3A4 (0.67) CYP3A4TSHRTDP1MAPK1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240016699-A1 PHARMACEUTICAL PACKAGES WITH COATINGS COMPRISING POLYCYANURATES CORNING INC (US) 2024-01-18 — — US disclosed
US-11839700-B2 Bio-electrode composition, bio-electrode, and method for manufacturing a bio-electrode SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-12-12 — — US disclosed
US-11707411-B2 Pharmaceutical packages with coatings comprising polycyanurates CORNING INCORPORATED (US) 2023-07-25 — — US disclosed
US-20180215876-A1 STRETCHABLE FILM AND METHOD FOR FORMING THE STRETCHABLE FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-08-02 — — US disclosed
US-20180142111-A1 AQUEOUS DISPERSION, METHOD FOR MANUFACTURING THE SAME, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2018-05-24 — — US disclosed
US-20180134860-A1 STRETCHABLE FILM, METHOD FOR FORMING THE SAME, STRETCHABLE WIRING FILM, AND METHOD FOR MANUFACTURING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-05-17 — — US disclosed
US-20180127612-A1 AQUEOUS DISPERSION, METHOD FOR MANUFACTURING THE SAME, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2018-05-10 — — US disclosed
US-20180118915-A1 STRETCHABLE FILM, METHOD FOR FORMING THE SAME, STRETCHABLE WIRING FILM, AND METHOD FOR MANUFACTURING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-05-03 — — US disclosed
US-20170349771-A1 WATER DISPERSION OF GEL PARTICLES, PRODUCING METHOD THEREOF, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2017-12-07 — — US disclosed
US-20170335076-A1 STRETCHABLE FILM AND METHOD FOR FORMING THE SAME, METHOD FOR MANUFACTURING COATED WIRING SUBSTRATE, AND STRETCHABLE WIRING FILM AND METHOD FOR MANUFACTURING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-11-23 — — US disclosed
US-20170166766-A1 GEL PARTICLES, PHOTOSENSITIVE COMPOSITION, INK COMPOSITION, METHOD OF PRODUCING WATER DISPERSION OF GEL PARTICLES, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2017-06-15 — — US disclosed
US-20170015621-A1 TWO-STEP AND ONE-POT PROCESSES FOR PREPARATION OF ALIPHATIC DIISOCYANATES GREAT EASTERN RESINS INDUSTRIAL CO., LTD. (TW) 2017-01-19 — — US disclosed
US-20160282770-A1 MEANDER CONTROL MEMBER, TRANSFER BELT, TRANSFER UNIT, AND IMAGE-FORMING APPARATUS FUJI XEROX CO., LTD. (JP) 2016-09-29 — — US disclosed
US-20160145373-A1 RESIN FORMULATIONS, RESIN POLYMERS AND COMPOSITE MATERIALS COMPRISING THE RESIN POLYMERS INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2016-05-26 — — US disclosed
US-20160070210-A1 ENDLESS BELT, TRANSFER UNIT, AND IMAGE FORMING APPARATUS FUJI XEROX CO., LTD. (JP) 2016-03-10 — — US disclosed
US-8470913-B2 Thermosetting resin composition and cured product of the same DIC CORPORATION (JP) 2013-06-25 — — US disclosed
US-20120142829-A1 THERMOSETTING RESIN COMPOSITION AND CURED PRODUCT OF THE SAME DIC CORPORATION (JP) 2012-06-07 — — US disclosed
US-8173220-B2 Method of producing metal plated material FUJIFILM CORPORATION (JP) 2012-05-08 — — US disclosed
US-20110183078-A1 METHOD OF PRODUCING METAL PLATED MATERIAL FUJIFILM CORPORATION (JP) 2011-07-28 — — US disclosed
US-20110088934-A1 METAL PATTERN FORMING METHOD, METAL PATTERN OBTAINED BY THE SAME, PRINTED WIRING BOARD, CONDUCTIVE FILM FORMING METHOD, AND CONDUCTIVE FILM OBTAINED BY THE SAME FUJIFILM CORPORATION (JP) 2011-04-21 — — 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 (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-20170015621-A1 TWO-STEP AND ONE-POT PROCESSES FOR PREPARATION OF ALIPHATIC DIISOCYANATES PARG, CDIPT, CDS2 CYP3A4 2725/4885TSHR 3928/4885TDP1 498/4885

“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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