SCHEMBL3343853

SCHEMBL3343853

S=c1[nH]cc(-c2ccc(Br)cc2)[nH]1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 2/20 0.64
GAA P10253 2/20 0.64
KDM4E B2RXH2 2/20 0.64
HDAC8 Q9BY41 1/20 0.60
ALDH1A1 P00352 5/20 0.56
MAPT P10636 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
POLB P06746 1/20 0.56
CACNA1B Q00975 1/20 0.56
APBA1 Q02410 1/20 0.56
MCL1 Q07820 1/20 0.56
IDO1 P14902 1/20 0.48
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
CCNB2 O95067 1/20 0.37
CDK1 P06493 1/20 0.37
CCNB1 P14635 1/20 0.37
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
CCNB3 Q8WWL7 1/20 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
SCHEMBL3342194 0.79 KDM4E (0.64) GFERGAAKDM4EHDAC8ALDH1A1
SCHEMBL3343038 0.79 GFER (0.64) GFERGAAKDM4EHDAC8ALDH1A1
SCHEMBL3344780 0.79 GAA (0.64) GFERGAAKDM4EHDAC8ALDH1A1
SCHEMBL258911 0.78 GAA (1.00) GFERGAAKDM4EHDAC8ALDH1A1
SCHEMBL3341447 0.77 KDM4E (0.61) GFERGAAKDM4EHDAC8ALDH1A1
Hydrochloric Acid SCHEMBL3342876 0.77 GAA (0.96) GFERGAAKDM4EHDAC8ALDH1A1
SCHEMBL15568639 0.75 HDAC8 (1.00) GFERGAAKDM4EHDAC8ALDH1A1
SCHEMBL3343847 0.75 ALDH1A1 (0.58) GFERGAAKDM4EHDAC8ALDH1A1
SCHEMBL3349475 0.75 HDAC8 (0.59) GFERGAAKDM4EHDAC8ALDH1A1
SCHEMBL638777 0.75 GFER (0.58) GFERGAAKDM4EHDAC8ALDH1A1

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 7 patents. 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-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 disclosed
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 disclosed
CN-101678000-A Use of 4-phenyl-imidazole-2-thiones as tyrosinase inhibitors for preparing pharmaceutical or cosmetic compositions for treating or preventing pigment disorders GALDERMA RES & DEV 2010-03-24 CN disclosed
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 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 (1 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 GFER 2509/4885GAA 58/4885KDM4E 1018/4885

“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.