SCHEMBL394900

SCHEMBL394900

CC(C)c1ccccc1CN

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.44
GABRB2 P47870 2/20 0.44
PNMT P11086 2/20 0.44
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
DPP4 P27487 2/20 0.41
TSHR P16473 2/20 0.41
FAAH O00519 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
GABRB1 P18505 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2C P28335 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41

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
SCHEMBL16814941 0.83 DPP4 (0.52) GABRA1GABRB2PNMTGABRG2GABRB3
SCHEMBL23771351 0.82 GABRA1 (0.43) GABRA1GABRB2PNMTGABRG2GABRB3
SCHEMBL3842659 0.82 TAAR1 (0.54) GABRA1GABRB2GABRG2GABRB3TSHR
SCHEMBL2778070 0.82 PNMT (0.41) GABRA1GABRB2PNMTGABRG2GABRB3
SCHEMBL394464 0.80 TSHR (0.55) GABRA1GABRB2PNMTDPP4TSHR
SCHEMBL10349024 0.80 GABRA1 (0.42) GABRA1GABRB2PNMTGABRG2GABRB3
SCHEMBL19553673 0.80 PNMT (0.54) GABRA1GABRB2PNMTGABRG2GABRB3
SCHEMBL13976077 0.80 GABRA1 (0.42) GABRA1GABRB2PNMTGABRG2GABRB3
SCHEMBL9839884 0.80 GABRA1 (0.48) GABRA1GABRB2GABRG2GABRB3TSHR
SCHEMBL23005062 0.80 NISCH (0.41) LMNACYP1A2CYP3A4TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3896125-B1 A RUBBER COMPOSITION AND A RUBBER PRODUCT GOODYEAR TIRE & RUBBER (US) 2024-10-02 EP claimed
EP-2678364-B1 RHEOLOGICAL AGENT FOR RADIATION-CURABLE COATING MATERIALS BASF SE (DE) 2015-04-08 EP claimed
WO-2012113739-A1 RHEOLOGICAL AGENT FOR RADIATION-CURABLE COATING MATERIALS BASF SE (DE) 2012-08-30 WO claimed
EP-2178828-A1 ALDIMINES AND COMPOSITIONS COMPRISING ALDAMINE Sika Technology AG (CH) 2010-04-28 EP claimed
WO-2009010522-A1 ALDIMINES AND COMPOSITIONS COMPRISING ALDAMINE SIKA TECHNOLOGY AG (CH) 2009-01-22 WO claimed
EP-2017260-A1 Aldimines and compounds containing aldimine Sika Technology AG (CH) 2009-01-21 EP claimed
WO-2007006585-A2 SYNTHESIS OF A POROUS AND/OR STRATIFIED STRUCTURE MANGANESE OXIDE ELSPER RUEDIGER (DE) 2007-01-18 WO claimed
EP-0627912-B1 GELS FOR ENCAPSULATION OF BIOLOGICAL MATERIALS UNIV TEXAS (US) 2004-05-12 EP claimed
US-11858946-B2 Small molecules active against gram-negative bacteria THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-01-02 US disclosed
US-11858946-B2 Small molecules active against gram-negative bacteria THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-01-02 US disclosed
US-20230381149-A1 RILUZOLE PRODRUGS AND THEIR USE BEETLEJUICE SA LLC, AS PURCHASER AGENT 2023-11-30 US disclosed
US-20230365588-A1 DIOL DESYMMETRIZATION BY NUCLEOPHILIC AROMATIC SUBSTITUTION AMGEN INC. (US) 2023-11-16 US disclosed
EP-3661921-B1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NODTHERA LTD (GB) 2023-10-18 EP disclosed
US-11697804-B2 Transcriptionally targeted and CpG-free plasmid for theranostic gene therapy THE JOHNS HOPKINS UNIVERSITY (US) 2023-07-11 US disclosed
EP-1219612-A1 2-IMINO-1,3-THIAZINE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2002-07-03 EP disclosed
US-20010020075-A1 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-09-06 US disclosed
EP-1113026-A2 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-07-04 EP disclosed
EP-0279239-B1 MICROBICIDES CIBA-GEIGY AG (CH) 1992-11-11 EP disclosed
EP-0279239-A1 Microbicides CIBA-GEIGY AG (CH) 1988-08-24 EP disclosed
EP-0198369-A2 Process for the preparation of perylene-3,4,9,10-tetracarboxylic-acid aryl imides HOECHST AKTIENGESELLSCHAFT (DE) 1986-10-22 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 (4 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-20230365588-A1 DIOL DESYMMETRIZATION BY NUCLEOPHILIC AROMATIC SUBSTITUTION MCL1, BAK1, BCL2A1 GABRA1 3917/4885GABRB2 4436/4885PNMT 2008/4885
US-11697804-B2 Transcriptionally targeted and CpG-free plasmid for theranostic gene therapy POLRMT, HDGF, PCNP GABRA1 4624/4885GABRB2 4556/4885PNMT 1117/4885
US-11858946-B2 Small molecules active against gram-negative bacteria PGLS, MRPL21, CLPP GABRA1 3819/4885GABRB2 2394/4885PNMT 1477/4885
US-20230381149-A1 RILUZOLE PRODRUGS AND THEIR USE APEH, ALDH1A2, UGT1A9 GABRA1 1837/4885GABRB2 1810/4885PNMT 2244/4885

“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.