SCHEMBL3928009

SCHEMBL3928009

On1cc(-c2cccs2)[nH]c1=S

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
RAB9A P51151 2/20 0.60
GAA P10253 3/20 0.46
GFER P55789 1/20 0.46
CHRNE Q04844 1/20 0.41
CCNB2 O95067 1/20 0.41
CDK1 P06493 1/20 0.41
CCNB1 P14635 1/20 0.41
GSK3B P49841 1/20 0.41
CDK5 Q00535 1/20 0.41
CDK5R1 Q15078 1/20 0.41
CCNB3 Q8WWL7 1/20 0.41
MAPT P10636 5/20 0.40
POLB P06746 2/20 0.40
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 5/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL4741222 0.76 RAB9A (1.00) MEN1KMT2ARAB9AGAAGFER
SCHEMBL3159586 0.71 RAB9A (0.59) MEN1KMT2ARAB9AGAAGFER
SCHEMBL4024470 0.68 GAA (0.57) MEN1KMT2ARAB9AGAAGFER
SCHEMBL12727897 0.66 GAA (0.55) MEN1KMT2ARAB9AGAAGFER
SCHEMBL3159532 0.66 MAOA (0.41) MEN1KMT2ARAB9AGAAGFER
SCHEMBL17548487 0.66 TAS2R38 (0.54) MEN1KMT2ARAB9AGAAGFER
SCHEMBL16291133 0.62 L3MBTL1 (0.57) MEN1KMT2ARAB9AGAAMAPT
SCHEMBL3545 0.62 L3MBTL1 (0.57) MEN1KMT2ARAB9AGAAMAPT
SCHEMBL3168760 0.61 KMT2A (0.65) MEN1KMT2ARAB9AGAAMAPT
SCHEMBL29443918 0.61 POLB (0.50) MEN1KMT2ARAB9AGAAGFER

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2041095-A1 NOVEL TYROSINASE INHIBITORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2009-04-01 EP disclosed
WO-2008006824-A1 NOVEL TYROSINASE INHIBITORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-01-17 WO disclosed