SCHEMBL16900337

SCHEMBL16900337

COC(=O)C(CS)N(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ CHRNB2 P17787 6/20 0.33
▸ CHRNA4 P43681 6/20 0.33
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CHRNB4 P30926 4/20 0.32
▸ CHRNA3 P32297 4/20 0.32
▸ CA14 Q9ULX7 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA7 P43166 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ ZDHHC7 Q9NXF8 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ ALOX15 P16050 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
SCHEMBL11927631 0.81 TSHR (0.33) TSHRHSD17B10SMN1; SMN2KDM4EMAPT
SCHEMBL4587194 0.80 CPB2 (0.41) HSD17B10CHRNB2CHRNA4CA1CA2
Hydrochloric Acid SCHEMBL10770242 0.79 TSHR (0.32) TSHRHSD17B10SMN1; SMN2MEN1KMT2A
SCHEMBL27262981 0.79 SMN1; SMN2 (0.37) TSHRSMN1; SMN2CHRNB2CHRNA4CA1
SCHEMBL8814579 0.79 SMN1; SMN2 (0.37) TSHRSMN1; SMN2CHRNB2CHRNA4CA1
SCHEMBL8377128 0.79 CA1 (0.42) TSHRSMN1; SMN2CHRNB2CHRNA4CA1
SCHEMBL8814582 0.79 SMN1; SMN2 (0.37) TSHRSMN1; SMN2CHRNB2CHRNA4CA1
SCHEMBL10328399 0.77 SMN1; SMN2 (0.36) SMN1; SMN2CHRNB2CHRNA4CA1CA2
SCHEMBL10328425 0.77 SMN1; SMN2 (0.36) SMN1; SMN2CHRNB2CHRNA4CA1CA2
SCHEMBL30207652 0.77 LMNA (0.30) CA1CA2KMT2ACA7

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-9079994-B2 Polymerizable compositions GC CORPORATION (JP) 2015-07-14 — — US disclosed
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