SCHEMBL4671972

SCHEMBL4671972

[CH2]CS(=O)(=O)CCCCCN

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.40
CA2 P00918 3/20 0.40
LMNA P02545 3/20 0.40
TSHR P16473 3/20 0.40
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA3 P07451 2/20 0.40
CA4 P22748 2/20 0.40
CA6 P23280 2/20 0.40
CA5A P35218 2/20 0.40
CA7 P43166 2/20 0.40
CA9 Q16790 2/20 0.40
CA14 Q9ULX7 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
BLM P54132 2/20 0.40
APP P05067 1/20 0.39
ALDH1A1 P00352 3/20 0.37
PMP22 Q01453 2/20 0.37
GMNN O75496 1/20 0.37
TP53 P04637 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
SCHEMBL11883063 0.84 DNM1 (0.50) DNM1CA2LMNATSHRCA12
SCHEMBL17495626 0.84 DNM1 (0.50) DNM1CA2LMNATSHRCA12
SCHEMBL6777358 0.78
SCHEMBL4258162 0.76 CA2 (0.31) CA2
SCHEMBL7643348 0.75 CA2 (0.58) CA2TSHRTHRB
SCHEMBL11094417 0.75 CA2 (0.58) CA2TSHRTHRB
SCHEMBL4449113 0.75 CA2 (0.58) CA2TSHRTHRB
SCHEMBL8895265 0.75 CA2 (0.58) CA2TSHRTHRB
SCHEMBL8957647 0.75 CA2 (0.58) CA2TSHRTHRB
SCHEMBL5139188 0.75 CA2 (0.35) DNM1CA2LMNATSHRCA12

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-1934292-A1 DYES AND DYE MIXTURES FOR DYING POLYMERS, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2008-06-25 EP disclosed
WO-2007039525-A1 DYES AND DYE MIXTURES FOR DYING POLYMERS, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-04-12 WO disclosed