SCHEMBL17359706

SCHEMBL17359706

C=CC(OS(N)(=O)=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 9/20 0.39
CA2 P00918 9/20 0.39
CA9 Q16790 9/20 0.39
BLM P54132 1/20 0.37
CA12 O43570 4/20 0.36
CA7 P43166 2/20 0.36
KDM4E B2RXH2 3/20 0.36
MAPT P10636 3/20 0.36
HPGD P15428 2/20 0.36
CYP3A4 P08684 2/20 0.36
ALOX15 P16050 2/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
ALOX12 P18054 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA14 Q9ULX7 2/20 0.34
CA3 P07451 1/20 0.34
CA4 P22748 1/20 0.34

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
SCHEMBL778796 0.85 MAPT (0.37) CA1CA2CA9CA12CA7
SCHEMBL1169874 0.81 KDM4E (0.39) KDM4EMAPTHPGDCYP3A4ALOX15
SCHEMBL778797 0.81 SRC (0.40) KDM4EMAPTHPGDCYP3A4ALOX15
SCHEMBL31069159 0.79 MAPT (0.35) CA1CA2CA9KDM4EMAPT
SCHEMBL10414695 0.78 HRH1 (0.37) CA1CA2CA9CA12CA7
SCHEMBL18725670 0.77 MAPT (0.33) CA1CA2CA9CA12CA7
SCHEMBL11814137 0.76 KMT2A (0.46) CA1CA2CA9KDM4EMAPT
SCHEMBL4864044 0.74 C5AR1 (0.41) CA1CA2CA9CA12KDM4E
SCHEMBL11814147 0.74 CYP1A2 (0.37) KDM4EMAPTHPGDCYP3A4ALOX15
SCHEMBL3802806 0.73 CYP2C19 (0.36) KDM4EMAPTHPGDCYP3A4ALOX15

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
CN-104428292-B Phenylalkyl sulfamate compound and muscle relaxant composition comprising same 生物药品解决方案有限公司 2017-02-08 CN disclosed
US-9221783-B2 Phenylalkyl sulfamate compound and muscle relaxant composition comprising the same BIO-PHARM SOLUTIONS CO., LTD. (KR) 2015-12-29 US disclosed
CN-104428292-A Phenylalkyl sulfamate compound and muscle relaxant composition comprising same BIO PHARM SOLUTIONS CO LTD 2015-03-18 CN disclosed