SCHEMBL83864

SCHEMBL83864

CN1C(=O)c2ccc(C#Cc3ccccc3)cc2C1=O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 15/20 0.60
APP P05067 1/20 0.53
CASP3 P42574 1/20 0.47
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL15326995 0.91 ALDH1A1 (0.53) GRM5APPCASP3ALDH1A1MEN1
SCHEMBL23980507 0.88 APP (0.56) GRM5APPALDH1A1MEN1MAPT
SCHEMBL22242553 0.87 GRM5 (0.54) GRM5APP
SCHEMBL10035484 0.84 GRM5 (0.47) GRM5APPCASP3ALDH1A1MEN1
SCHEMBL14326433 0.83 GRM5 (0.56) GRM5APP
SCHEMBL21028319 0.82 ALDH1A1 (0.49) GRM5APPCASP3ALDH1A1MEN1
SCHEMBL504644 0.82 GRM5 (0.60) GRM5ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL16927161 0.81 GRM5 (0.54) GRM5ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL7678431 0.81 ESR1 (0.58) GRM5ALDH1A1MEN1KMT2A
SCHEMBL14326160 0.81 GRM5 (0.63) GRM5MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037319-B2 Curable compound DAICEL CORPORATION (JP) 2024-07-16 US disclosed
US-12037319-B2 Curable compound DAICEL CORPORATION (JP) 2024-07-16 US disclosed
US-20240067777-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2024-02-29 US disclosed
US-20240067777-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2024-02-29 US disclosed
US-20240026076-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2024-01-25 US disclosed
US-20240026076-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2024-01-25 US disclosed
US-20230373916-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2023-11-23 US disclosed
US-20230373916-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2023-11-23 US disclosed
US-20230260787-A1 COMPOSITION FOR FORMING PROTECTIVE FILM AGAINST ALKALINE AQUEOUS HYDROGEN PEROXIDE, SUBSTRATE FOR PRODUCING SEMICONDUCTOR APPARATUS, METHOD FOR FORMING PROTECTIVE FILM, AND METHOD FOR FORMING PATTERN SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-08-17 US disclosed
US-11676814-B2 Material for forming organic film, substrate for manufacturing semiconductor apparatus, method for forming organic film, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-06-13 US disclosed
EP-1994078-B1 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING IBM (US) 2009-07-01 EP disclosed
WO-2008151184-A1 BENZAMIDE MGLUR5 POSITIVE ALLOSTERIC MODULATORS AND METHODS OF MAKING AND USING SAME VANDERBILT UNIVERSITY (US) 2008-12-11 WO disclosed
WO-2008151184-A1 BENZAMIDE MGLUR5 POSITIVE ALLOSTERIC MODULATORS AND METHODS OF MAKING AND USING SAME VANDERBILT UNIVERSITY (US) 2008-12-11 WO disclosed
US-20080219135-A1 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING GLOBALFOUNDRIES U.S. INC. 2008-09-11 US disclosed
US-20080175135-A1 DATA STORAGE MEDIUM AND METHOD FOR HIGH DENSITY DATA STORAGE DUERIG URS T 2008-07-24 US disclosed
US-20080076903-A1 DATA STORAGE MEDIUM AND METHOD FOR HIGH DENSITY DATA STORAGE INTERNATIONAL BUSINESS MACHINES CORPORATION 2008-03-27 US disclosed
WO-2007096359-A2 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2007-08-30 WO disclosed
US-20070195682-A1 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING GLOBALFOUNDRIES INC. (KY) 2007-08-23 US disclosed
US-20070195682-A1 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING GLOBALFOUNDRIES INC. (KY) 2007-08-23 US disclosed
US-20070196645-A1 Method for high density data storage and imaging INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2007-08-23 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 (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-12037319-B2 Curable compound CCT5, PGA5, KDM5B GRM5 369/4885APP 3185/4885CASP3 1212/4885
US-20230373916-A1 CURABLE COMPOUND PRODUCT RPLP0, SSRP1, RPP30 GRM5 3344/4885APP 2210/4885CASP3 1969/4885

“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.