SCHEMBL798981

SCHEMBL798981

Cc1ccc(OC#N)cc1OC#N

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 8/20 0.39
GAA P10253 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP1A1 P04798 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP1B1 Q16678 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTR2A P28223 1/20 0.30
SLC6A4 P31645 1/20 0.30
ACHE P22303 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
SCHEMBL11338994 0.83 AR (0.34) ARGAACA12CA1CA2
SCHEMBL9719145 0.83 TDP1 (0.41) TDP1ALDH1A1HTR2ASLC6A4
SCHEMBL29489131 0.83 TDP1 (0.41) TDP1ALDH1A1HTR2ASLC6A4
SCHEMBL11108932 0.81 TSHR (0.44) GAATDP1CYP1A2ALDH1A1ACHE
SCHEMBL29048033 0.80 CA12 (0.34) ARCYP1A1CYP1A2CYP1B1CA12
SCHEMBL24203435 0.78 ALDH1A1 (0.45) GAATDP1ALDH1A1
SCHEMBL13728524 0.78 MAPT (0.35) ARCYP1A2ALDH1A1
SCHEMBL20432862 0.78 TSHR (0.43) ARGAAALDH1A1
SCHEMBL16939068 0.78 HTR2A (0.42) ARTDP1CYP1A2ALDH1A1HTR2A
SCHEMBL25991389 0.78 CYP1A2 (0.36) GAACYP1A2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024144255-A1 ACID OR MOISTURE REDUCING AGENT FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE COMPRISING SAME, LITHIUM SECONDARY BATTERY CONTAINING NON-AQUEOUS ELECTROLYTE, AND METHOD FOR REDUCING ACID OR MOISTURE IN NON-AQUEOUS ELECTROLYTE 주식회사 엘지에너지솔루션 2024-07-04 WO disclosed
US-12017188-B2 Dendrimer particles and related mixed matrix filtration membranes, compositions, methods, and systems CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2024-06-25 US disclosed
US-20230348657-A1 SYNTHESIS OF LINEAR POLYOXAZOLIDINONES USING URETDIONES AS DIISOCYANATE COMPONENT BASF SE (DE) 2023-11-02 US disclosed
US-20230295368-A1 CATALYST FOR DISSOCIATION OF BLOCKING AGENT FOR BLOCKED ISOCYANATES, AND THERMOSETTING COMPOSITION CONTAINING SAID CATALYST FOR DISSOCIATION OF BLOCKING AGENT KOEI CHEMICAL COMPANY, LIMITED (JP) 2023-09-21 US disclosed
US-20230279158-A1 CHARGE-BEARING CYCLODEXTRIN POLYMERIC MATERIALS AND METHODS OF MAKING AND USING SAME AVENUE GLOBAL DISLOCATION OPPORTUNITIES FUND, L.P. AND AVENUE GLOBAL OPPORTUNITIES MASTER FUND, L.P. 2023-09-07 US disclosed
US-11718704-B2 Catalyst for dissociation of blocking agent for blocked isocyanates, and thermosetting composition containing said catalyst for dissociation of blocking agent KOEI CHEMICAL COMPANY, LIMITED (JP) 2023-08-08 US disclosed
US-20230220227-A1 INK JET RECORDING METHOD FUJIFILM CORPORATION (JP) 2023-07-13 US disclosed
EP-4190217-A1 CLEANING WIPER BLADE CANON KABUSHIKI KAISHA (JP) 2023-06-07 EP disclosed
US-20230157492-A1 CLEANING WIPER BLADE CANON KABUSHIKI KAISHA (JP) 2023-05-25 US disclosed
US-20230159692-A1 VEHICLE WIPER BLADE CANON KABUSHIKI KAISHA (JP) 2023-05-25 US disclosed
CN-101772553-A Thermosetting Damping Material DOW GLOBAL TECHNOLOGIES INC 2010-07-07 CN disclosed
US-20100040978-A1 PHOTOSENSITIVE LITHOGRAPHIC PRINTING PLATE MATERIAL KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2010-02-18 US disclosed
US-20080145785-A1 Light sensitive planographic printing plate material KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-06-19 US disclosed
US-20080038667-A1 Light sensitive planographic printing plate material KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-02-14 US disclosed
US-20080020323-A1 Light sensitive planographic printing plate material KONICA MINOLTA MEDICAL & GRAPHIC, INC. 2008-01-24 US disclosed
US-20070207407-A1 Light sensitive planographic printing plate material KONICA MINOLTA MEDICAL & GRAPHIC, INC. 2007-09-06 US disclosed
US-20070006760-A1 Hydrophilic substrate for lithographic printing plate FUJI PHOTO FILM CO., LTD. 2007-01-11 US disclosed
EP-1742109-A2 Hydrophilic substrate for lithographic printing plate Fuji Photo Film Co., Ltd. (JP) 2007-01-10 EP disclosed
EP-0702039-B1 Isocyanate prepolymers, their preparation process and their use BAYER AG (DE) 1999-04-14 EP disclosed
EP-0702039-A1 Isocyanate prepolymers, their preparation process and their use BAYER AG (DE) 1996-03-20 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 (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-20230295368-A1 CATALYST FOR DISSOCIATION OF BLOCKING AGENT FOR BLOCKED ISOCYANATES, AND THERMOSETTING COMPOSITION CONTAINING SAID CATALYST FOR DISSOCIATION OF BLOCKING AGENT IDH3A, RCOR1, MUS81 AR 227/4885GAA 3607/4885TDP1 2293/4885
US-11718704-B2 Catalyst for dissociation of blocking agent for blocked isocyanates, and thermosetting composition containing said catalyst for dissociation of blocking agent IDH3A, RCOR1, MUS81 AR 227/4885GAA 3607/4885TDP1 2293/4885

“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.