SCHEMBL17613698

SCHEMBL17613698

CCC(=O)SCOCCO

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.38
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL17613646 0.89 TSHR (0.37) TSHRALDH1A1MEN1KMT2ATHRB
SCHEMBL12023038 0.81 TSHR (0.46) TSHRALDH1A1MEN1KMT2ATHRB
SCHEMBL17613638 0.78 ALDH1A1 (0.31) ALDH1A1
SCHEMBL17613692 0.76 TSHR (0.36) TSHRALDH1A1MEN1KMT2ATHRB
SCHEMBL17613702 0.75 TSHR (0.35) TSHRALDH1A1MEN1KMT2AMAPK1
SCHEMBL17613686 0.75 DNM1 (0.34) TSHRALDH1A1MEN1KMT2ATHRB
SCHEMBL17613695 0.72 TSHR (0.36) TSHRALDH1A1MEN1KMT2AMAPK1
SCHEMBL17613649 0.72 TSHR (0.36) TSHRALDH1A1MEN1KMT2AMAPK1
SCHEMBL14231681 0.72
SCHEMBL17613731 0.71 THRA (0.31) THRBKDM4ESMN1; SMN2

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
EP-2346883-B1 SELF DELIVERING BIO-LABILE PHOSPHATE PROTECTED PRO-OLIGOS FOR OLIGONUCLEOTIDE BASED THERAPEUTICS AND MEDIATING RNA INTERFERENCE PETERSEN SCOTT G (US) 2016-03-23 EP disclosed