SCHEMBL28065031

SCHEMBL28065031

O=C(S)CCCCCCCCC(=O)S

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.47
LMNA P02545 3/20 0.47
NFKB1 P19838 1/20 0.47
PMP22 Q01453 1/20 0.47
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
GPR84 Q9NQS5 5/20 0.38
CES2 O00748 3/20 0.38
CES1 P23141 3/20 0.38
FFAR1 O14842 2/20 0.38
FFAR4 Q5NUL3 2/20 0.38
FOLH1 Q04609 1/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 1/20 0.38
PPARG P37231 6/20 0.36
PPARD Q03181 6/20 0.36

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
SCHEMBL27712598 1.00 TSHR (0.47) TSHRLMNANFKB1PMP22HDAC3
SCHEMBL28138992 1.00 TSHR (0.47) TSHRLMNANFKB1PMP22HDAC3
SCHEMBL27924265 0.96 TSHR (0.44) TSHRLMNANFKB1PMP22HDAC3
SCHEMBL11348207 0.96 LMNA (0.44) TSHRLMNANFKB1PMP22HDAC3
SCHEMBL27924266 0.92 LMNA (0.41) TSHRLMNANFKB1PMP22HDAC3
SCHEMBL8050134 0.88
SCHEMBL10714917 0.87 TSHR (0.71) TSHRLMNANFKB1PMP22GPR84
SCHEMBL18869613 0.87 TSHR (0.71) TSHRLMNANFKB1PMP22GPR84
SCHEMBL2634003 0.87 FOLH1 (0.57) TSHRLMNANFKB1PMP22HDAC3
SCHEMBL19741462 0.87 FOLH1 (0.57) TSHRLMNANFKB1PMP22HDAC3

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
CN-105452261-A Continuous process for the preparation of thiocarboxylate silane MOMENTIVE PERFORMANCE MAT INC 2016-03-30 CN disclosed