SCHEMBL5157375

SCHEMBL5157375

Cc1ccc(C(COS(C)(=O)=O)OC2CCCCO2)cc1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SLC12A2 P55011 1/20 0.33
SLC12A5 Q9H2X9 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
TP53 P04637 1/20 0.30
SLC6A3 Q01959 2/20 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
SCHEMBL7266175 0.89 SLC12A2 (0.37) SLC12A2SLC12A5CHRM2CHRM1POLB
SCHEMBL5153999 0.89 SMN1; SMN2 (0.34) CHRM2CHRM1POLBGAASLC6A3
SCHEMBL5158934 0.89 CA12 (0.37) MEN1KMT2ASLC6A3
SCHEMBL5154401 0.89 SLC6A3 (0.40) MEN1KMT2AGAASLC6A3
SCHEMBL5154407 0.89 SLC6A3 (0.40) MEN1KMT2AGAASLC6A3
SCHEMBL5154394 0.89 SLC6A3 (0.40) MEN1KMT2AGAASLC6A3
SCHEMBL5154408 0.89 SLC6A3 (0.40) MEN1KMT2AGAASLC6A3
SCHEMBL5159871 0.88 ALDH1A1 (0.37) MEN1KMT2ACHRM2CHRM1L3MBTL1
SCHEMBL5154654 0.87 PTGDR (0.32) KMT2A
SCHEMBL5173257 0.86 HPGD (0.33) TP53SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1236714-B1 ACETALSULFONATE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND PROCESS FOR PRODUCING STYRENE OXIDE DERIVATIVE MITSUBISHI RAYON CO (JP) 2007-01-17 EP disclosed
US-6642395-B1 Esterifying mandelic acid derivative; protecting hydroxyl group and reducing ester; sulfonating and epoxidizing MITSUBISHI RAYON CO., LTD. (JP) 2003-11-04 US disclosed
EP-1236714-A1 ACETALSULFONATE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND PROCESS FOR PRODUCING STYRENE OXIDE DERIVATIVE Mitsubishi Rayon Co., Ltd. (JP) 2002-09-04 EP disclosed