SCHEMBL13930284

SCHEMBL13930284

CCCCCCCCCCCCS(=O)(=O)Oc1cc(=O)sc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALPL P05186 4/20 0.46
▸ ALPI P09923 4/20 0.46
▸ FAAH O00519 1/20 0.42
▸ MGLL Q99685 1/20 0.42
▸ HTT P42858 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ BRD4 O60885 1/20 0.36
▸ CNR2 P34972 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ BRAF P15056 2/20 0.33
▸ MAPT P10636 1/20 0.33

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
SCHEMBL13930285 0.79 ALPI (0.48) ALPLALPISMN1; SMN2
SCHEMBL13930276 0.76 ALPL (0.56) ALPLALPI
SCHEMBL3041264 0.74 HTR1B (0.46) ALPLALPICNR2
SCHEMBL4481326 0.74 HTR1B (0.46) ALPLALPICNR2
SCHEMBL6251532 0.74 HTR1B (0.46) ALPLALPICNR2
SCHEMBL4853557 0.74 HTR1B (0.46) ALPLALPICNR2
SCHEMBL7784375 0.74 HTR1B (0.46) ALPLALPICNR2
SCHEMBL4480661 0.74 HTR1B (0.46) ALPLALPICNR2
SCHEMBL4224295 0.74 HTR1B (0.46) ALPLALPICNR2
SCHEMBL3921943 0.74 HTR1B (0.46) ALPLALPICNR2

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
US-20090045552-A1 Positive resist composition for recording medium master, and method of producing recording medium master and method of producing stamper using the same IMAI GENJI 2009-02-19 — — US disclosed
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