SCHEMBL258911

SCHEMBL258911

S=c1[nH]cc(-c2ccccc2)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 1.00
GFER P55789 2/20 1.00
KDM4E B2RXH2 2/20 1.00
HDAC8 Q9BY41 1/20 0.64
ALDH1A1 P00352 5/20 0.55
MAPT P10636 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
POLB P06746 1/20 0.55
CACNA1B Q00975 1/20 0.55
APBA1 Q02410 1/20 0.55
MCL1 Q07820 1/20 0.55
TAS2R38 P59533 1/20 0.52
IDO1 P14902 2/20 0.45
RAB9A P51151 4/20 0.41
CYP3A4 P08684 2/20 0.39
NOTUM Q6P988 1/20 0.39
NPC1 O15118 2/20 0.38
NPY5R Q15761 1/20 0.38
SCN2A Q99250 1/20 0.38
MEN1 O00255 2/20 0.37

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
Hydrochloric Acid SCHEMBL3342876 0.98 GAA (0.96) GAAGFERKDM4EHDAC8ALDH1A1
Morpholine SCHEMBL3636258 0.83 GFER (0.69) GAAGFERKDM4EHDAC8ALDH1A1
SCHEMBL3344780 0.78 GAA (0.64) GAAGFERKDM4EHDAC8ALDH1A1
SCHEMBL15568639 0.78 HDAC8 (1.00) GAAGFERKDM4EHDAC8ALDH1A1
SCHEMBL3342194 0.78 KDM4E (0.64) GAAGFERKDM4EHDAC8ALDH1A1
SCHEMBL3343853 0.78 GFER (0.64) GAAGFERKDM4EHDAC8ALDH1A1
SCHEMBL3343038 0.78 GFER (0.64) GAAGFERKDM4EHDAC8ALDH1A1
SCHEMBL638903 0.77 KDM4E (0.61) GAAGFERKDM4EHDAC8ALDH1A1
SCHEMBL3344186 0.77 KDM4E (0.61) GAAGFERKDM4EHDAC8ALDH1A1
SCHEMBL3341447 0.77 KDM4E (0.61) GAAGFERKDM4EHDAC8ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160401-A1 4-PHENYLIMIDAZOLE-2-THIONE TYROSINASE INHIBITORS AND TREATMENT OR PREVENTION OF PIGMENTARY DISORDERS THEREWITH GALDERMA RESEARCH & DEVELOPMENT, BIOT, FRANCE 2010-06-24 US claimed
EP-2164486-A2 USE OF 4-PHENYL-IMIDAZOLE-2-THIONES AS TYROSINASE INHIBITORS FOR PREPARING PHARMACEUTICAL OR COSMETIC COMPOSITIONS FOR TREATING OR PREVENTING PIGMENT DISORDERS Galderma Research & Development (FR) 2010-03-24 EP claimed
WO-2008152330-A2 USE OF 4-PHENYL-IMIDAZOLE-2-THIONES AS TYROSINASE INHIBITORS FOR PREPARING PHARMACEUTICAL OR COSMETIC COMPOSITIONS FOR TREATING OR PREVENTING PIGMENT DISORDERS GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-12-18 WO claimed
US-9592230-B2 Substituted imidazoles as PDE10A inhibitors H. LUNDBECK A/S (DK) 2017-03-14 US disclosed
US-20150190395-A1 Novel Phenylimidazole Derivatives as PDE10A Enzyme Inhibitors H. LUNDBECK A/S (DK) 2015-07-09 US disclosed
US-9018217-B2 Phenylimidazole derivatives as PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2015-04-28 US disclosed
US-20150025081-A1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS H. LUNDBECK A/S (DK) 2015-01-22 US disclosed
US-8865711-B2 Phenylimidazole derivatives as PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2014-10-21 US disclosed
EP-2318394-B1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS LUNDBECK & CO AS H (DK) 2014-01-22 EP disclosed
US-20120135987-A1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS H. LUNDBECK A/S (DK) 2012-05-31 US disclosed
US-8133897-B2 Phenylimidazole derivatives as PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2012-03-13 US disclosed
US-4912226-A A 1-(benyzlsubstituted-),2-((1,3-dioneisoindolin-2-yl)alkyl thio-)imidazole SMITHKLINE BECKMAN CORPORATION (US) 1990-03-27 US disclosed
US-4882348-A HYPOTENSIVE AGENTS SMITHKLINE BECKMAN CORPORATION (US) 1989-11-21 US disclosed
EP-0170775-B1 DERIVATIVES OF BICYCLIC AMINO ACIDS, PROCESSES FOR THEIR PREPARATION, AGENTS CONTAINING THEM AND THEIR USE AS WELL AS BICYCLIC AMINO ACIDS AS INTERMEDIATES AND PROCESS FOR THEIR PREPARATION HOECHST AKTIENGESELLSCHAFT (DE) 1989-11-08 EP disclosed
WO-1989006127-A1 2-AMINOALKYLTHIOIMIDAZOLES AS DOPAMINE-beta-HYDROXYLASE INHIBITORS SMITHKLINE BECKMAN CORPORATION (US) 1989-07-13 WO disclosed
WO-1989006128-A1 2-CARBOXYALKYLTHIOIMIDAZOLES AND ESTERS THEREOF AS DOPAMINE-beta-HYDROXYLASE INHIBITORS SMITHKLINE BECKMAN CORPORATION (US) 1989-07-13 WO disclosed
EP-0323148-A1 Dopamine-beta-hydroxylase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1989-07-05 EP disclosed
EP-0323146-A2 Dopamine-beta-hydroxylase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1989-07-05 EP disclosed
EP-0302603-A1 Dopamine-beta-hydroxylase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1989-02-08 EP disclosed
US-4798843-A HYPOTENSIVE AGENTS SMITHKLINE BECKMAN CORPORATION (US) 1989-01-17 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 (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-20100160401-A1 4-PHENYLIMIDAZOLE-2-THIONE TYROSINASE INHIBITORS AND TREATMENT OR PREVENTION OF PIGMENTARY DISORDERS THEREWITH TYR, TH, PAH GAA 58/4885GFER 2509/4885KDM4E 1018/4885
US-20150190395-A1 Novel Phenylimidazole Derivatives as PDE10A Enzyme Inhibitors PDE10A, PDE5A, PDE3B GAA 32/4885GFER 4049/4885KDM4E 356/4885
US-20120135987-A1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS PDE10A, PDE5A, PDE3B GAA 32/4885GFER 4049/4885KDM4E 356/4885
US-20150025081-A1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS PDE10A, PDE5A, PDE3B GAA 32/4885GFER 4049/4885KDM4E 356/4885

“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.