SCHEMBL8375418

SCHEMBL8375418

C=C(C)CNC(CCSC)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
RNPEP Q9H4A4 1/20 0.34
LMNA P02545 1/20 0.33
CA2 P00918 2/20 0.33
CA1 P00915 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL8375446 0.79 KMT2A (0.34) CA2CA1KMT2A
SCHEMBL9190837 0.77 TSHR (0.38) TSHRCA12CA9RNPEPLMNA
SCHEMBL8374364 0.77 TGFBR1 (0.40)
SCHEMBL8375419 0.77 TGFBR1 (0.46) TSHRCA12CA9RNPEPLMNA
SCHEMBL8376823 0.77 SIRT6 (0.38) RNPEPCA2CA1
SCHEMBL1694616 0.75 CA12 (0.44) TSHRCA12CA9RNPEPLMNA
SCHEMBL8374062 0.75 ECE1 (0.38)
SCHEMBL1694618 0.75 CA12 (0.44) TSHRCA12CA9RNPEPLMNA
SCHEMBL8378525 0.75 KDM4E (0.38) CA12CA9CA1SMN1; SMN2
SCHEMBL11032203 0.75 CA12 (0.44) TSHRCA12CA9RNPEPLMNA

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
US-5883211-A Thermoreversible hydrogels comprising linear copolymers and their use in electrophoresis ACLARA BIOSCIENCES, INC. (US) 1999-03-16 US disclosed
WO-1997040078-A1 THERMOREVERSIBLE HYDROGELS COMPRISING NON-CROSSLINKED COPOLYMERS AND THEIR USE IN ELECTROPHORESIS SOANE BIOSCIENCES (US) 1997-10-30 WO disclosed