SCHEMBL1978798

SCHEMBL1978798

N#Cc1ccc(-c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.68
MMP3 P08254 1/20 0.61
CYP11B2 P19099 1/20 0.59
GABRA1 P14867 1/20 0.58
GABRG2 P18507 1/20 0.58
GABRB3 P28472 1/20 0.58
GABRA5 P31644 1/20 0.58
GABRA3 P34903 1/20 0.58
MAOB P27338 3/20 0.56
MAOA P21397 2/20 0.56
KIF11 P52732 2/20 0.54
ALDH1A3 P47895 1/20 0.53
CYP1A1 P04798 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP1B1 Q16678 1/20 0.52
CA12 O43570 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
ALDH1A1 P00352 2/20 0.50
CA1 P00915 1/20 0.50

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
Benzene SCHEMBL28680466 1.00 TSHR (0.68) TSHRMMP3CYP11B2GABRA1GABRG2
Water SCHEMBL27280762 1.00 TSHR (0.68) TSHRMMP3CYP11B2GABRA1GABRG2
Water SCHEMBL27280164 1.00 TSHR (0.68) TSHRMMP3CYP11B2GABRA1GABRG2
SCHEMBL72569 1.00 TSHR (0.68) TSHRMMP3CYP11B2GABRA1GABRG2
Water SCHEMBL6336152 1.00 TSHR (0.68) TSHRMMP3CYP11B2GABRA1GABRG2
Hydrochloric Acid SCHEMBL4599950 0.97 TSHR (0.65) TSHRMMP3CYP11B2GABRA1GABRG2
SCHEMBL28503971 0.97 TSHR (0.65) TSHRMMP3CYP11B2GABRA1GABRG2
Hydrochloric Acid SCHEMBL2338378 0.97 TSHR (0.65) TSHRMMP3CYP11B2GABRA1GABRG2
Cyanide SCHEMBL28220142 0.95 TSHR (0.62) TSHRMMP3CYP11B2GABRA1GABRG2
SCHEMBL13682562 0.93 TSHR (0.59) TSHRMMP3CYP11B2GABRA1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118271580-A Anion exchange membrane prepared from aryl piperidine copolymer containing triazine ring branched structure, preparation method and application 大连理工大学 2024-07-02 CN claimed
CN-118271580-B Anion exchange membrane prepared from aryl piperidine copolymer containing triazine ring branched structure, preparation method and application 大连理工大学 2024-08-16 CN disclosed
CN-118271580-A Anion exchange membrane prepared from aryl piperidine copolymer containing triazine ring branched structure, preparation method and application 大连理工大学 2024-07-02 CN disclosed
US-20230399567-A1 Liquid Crystal Element and Emulsion Composition MITSUBISHI CHEMICAL CORPORATION (JP) 2023-12-14 US disclosed
WO-2023150908-A1 LIQUID CRYSTAL COMPOSITION AND PREPARATION METHOD THEREFOR, AND DISPLAY PANEL 京东方科技集团股份有限公司 2023-08-17 WO disclosed
EP-3802730-B1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-04-19 EP disclosed
CN-108603121-B Liquid crystal medium and high-frequency module containing same 默克专利股份有限公司 2023-02-10 CN disclosed
US-11444250-B2 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2022-09-13 US disclosed
US-20220146922-A1 TRANSMISSIVE SCREEN AND VIDEO IMAGE DISPLAY DEVICE NITTO DENKO CORPORATION (JP) 2022-05-12 US disclosed
US-11186773-B2 Liquid crystal compositions, mixtures, elements, and dimmable devices NITTO DENKO CORPORATION (JP) 2021-11-30 US disclosed
US-7507830-B2 Process for preparing unsymmetrical biaryls and alkylated aromatic compounds from arylnitriles PHARMACORE, INC. (US) 2009-03-24 US disclosed
CN-100410236-C Substituted methylene amide derivatives as protein tyrosine phosphatase modulators APPLIED RESEARCH SYSTEMS (CH) 2008-08-13 CN disclosed
US-7311897-B2 Triazines which are symmetrically substituted by phenyl, biphenyl, triphenyl or naphthyl can be used as highly effective UV absorbers for cosmetic applications CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-12-25 US disclosed
US-7311897-B2 Triazines which are symmetrically substituted by phenyl, biphenyl, triphenyl or naphthyl can be used as highly effective UV absorbers for cosmetic applications CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-12-25 US disclosed
US-6962999-B2 Process for preparing unsymmetrical biaryls and alkylated aromatic compounds from arylnitriles PHARMACORE, INC. (US) 2005-11-08 US disclosed
CN-1633410-A Substituted methylene amide derivatives as protein tyrosine phosphatase modulators APPLIED RESEARCH SYSTEMS (AN) 2005-06-29 CN disclosed
US-20050124808-A1 Process for preparing unsymmetrical biaryls and alkylated aromatic compounds from arylnitriles DSM I.P. ASSETS B.V. (NL) 2005-06-09 US disclosed
US-20030100760-A1 Process for preparing unsymmetrical biaryls and alkylated aromatic compounds from arylnitriles DSM N.V. (NL) 2003-05-29 US disclosed
EP-1279656-A2 Process for preparing unsymmetrical biaryls and alkylated aromatic compounds from arylnitriles DSM N.V. (NL) 2003-01-29 EP disclosed
US-4673529-A LIQUID CRYSTALS JLMOKOUM INTEGRATED CIRCUITS CHISSO CORPORATION (JP) 1987-06-16 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 (3 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-11444250-B2 Composition of matter for use in organic light-emitting diodes CRY2, ALDH1A2, CYBA TSHR 4747/4885MMP3 3661/4885CYP11B2 272/4885
US-20030100760-A1 Process for preparing unsymmetrical biaryls and alkylated aromatic compounds from arylnitriles AHR, PAH, DDT TSHR 2211/4885MMP3 4842/4885CYP11B2 731/4885
US-20050124808-A1 Process for preparing unsymmetrical biaryls and alkylated aromatic compounds from arylnitriles AHR, PAH, DDT TSHR 2211/4885MMP3 4842/4885CYP11B2 731/4885

“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.