SCHEMBL3839670

SCHEMBL3839670

O=C(O)CCCCCCCCCCCCCCCC(S)S

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.60
LMNA P02545 2/20 0.60
NFKB1 P19838 1/20 0.60
PMP22 Q01453 1/20 0.60
GSTK1 Q9Y2Q3 2/20 0.59
ENPEP Q07075 1/20 0.54
FFAR4 Q5NUL3 3/20 0.52
FFAR1 O14842 3/20 0.52
GPR84 Q9NQS5 4/20 0.50
ALDH1A1 P00352 3/20 0.50
FOLH1 Q04609 1/20 0.50
KMT2A Q03164 2/20 0.48
MAPT P10636 1/20 0.48
PPARG P37231 4/20 0.48
PPARD Q03181 4/20 0.48
PPARA Q07869 4/20 0.48
HDAC11 Q96DB2 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48

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
SCHEMBL2722834 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GSTK1
SCHEMBL380054 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GSTK1
SCHEMBL8814639 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GSTK1
SCHEMBL10489478 0.90
SCHEMBL15956044 0.85 TSHR (0.60) TSHRLMNANFKB1PMP22GSTK1
SCHEMBL1198436 0.81 GSTK1 (0.55) TSHRLMNANFKB1PMP22GSTK1
SCHEMBL11254501 0.81 GSTK1 (0.55) TSHRLMNANFKB1PMP22GSTK1
SCHEMBL8359558 0.81 GSTK1 (0.55) TSHRLMNANFKB1PMP22GSTK1
SCHEMBL14685943 0.81 GSTK1 (0.55) TSHRLMNANFKB1PMP22GSTK1
SCHEMBL14686086 0.81 GSTK1 (0.55) TSHRLMNANFKB1PMP22GSTK1

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-20090081371-A1 SUBSTRATE AND METHOD FOR PRODUCING THE SUBSTRATE FUJIFILM CORPORATION (JP) 2009-03-26 US disclosed
EP-2040076-A2 Substrate and method for producing the substrate FUJIFILM Corporation (JP) 2009-03-25 EP disclosed