SCHEMBL10518620

SCHEMBL10518620

NCCSc1ccsc1OC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.39
▸ PTPRC P08575 5/20 0.35
▸ PTPRG P23470 5/20 0.33
▸ PTGS2 P35354 4/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HSD17B10 Q99714 1/20 0.32
▸ KIF11 P52732 1/20 0.31
▸ IDO1 P14902 1/20 0.30
▸ KDM1A O60341 1/20 0.30
▸ RCOR1 Q9UKL0 1/20 0.30

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
SCHEMBL26765459 0.74 KMT2A (0.51) KMT2A
Hydrochloric Acid SCHEMBL9334343 0.73 KMT2A (0.50) KMT2A
SCHEMBL6550959 0.73 KMT2A (0.67) KMT2APTPRCPTPRGMAPTIDO1
SCHEMBL4634541 0.69 KMT2A (0.36) KMT2AMAPTHSD17B10
SCHEMBL17629372 0.69 MAPT (0.33) KMT2AMAPT
SCHEMBL8794570 0.67 PTPRC (0.56) KMT2APTPRCPTPRGMAPT
SCHEMBL9534144 0.67 LCK (0.33) KMT2A
SCHEMBL3671086 0.66 KMT2A (0.33) KMT2AMAPTHSD17B10
SCHEMBL9351950 0.66 GSK3B (0.41) KMT2AMAPT
SCHEMBL10587921 0.66 KMT2A (0.37) KMT2APTPRCMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0318682-A2 Tricyclic thiazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1989-06-07 — — EP disclosed
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