SCHEMBL8419045

SCHEMBL8419045

O=C(O)CCCCC(CC(O)=S)C(O)=S

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.44
▸ GSTK1 Q9Y2Q3 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ PMP22 Q01453 1/20 0.42
▸ ENPEP Q07075 1/20 0.41
▸ FOLH1 Q04609 5/20 0.40
▸ FFAR4 Q5NUL3 1/20 0.40
▸ FFAR1 O14842 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ SLC22A6 Q4U2R8 1/20 0.39

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
SCHEMBL8415657 0.98 LMNA (0.46) LMNAGSTK1TSHRNFKB1PMP22
SCHEMBL8416804 0.94 FOLH1 (0.44) LMNAGSTK1TSHRNFKB1PMP22
SCHEMBL8419050 0.90 FOLH1 (0.48) LMNAGSTK1TSHRNFKB1PMP22
SCHEMBL8415664 0.88 LMNA (0.48) LMNAGSTK1TSHRNFKB1PMP22
SCHEMBL1900376 0.85 FOLH1 (0.52) FOLH1
SCHEMBL8416810 0.83 FOLH1 (0.50) LMNAGSTK1TSHRNFKB1PMP22
Ammonia Solution, Strong SCHEMBL2546314 0.83 FOLH1 (0.50) FOLH1
SCHEMBL1900382 0.74 FOLH1 (0.67) FOLH1
SCHEMBL4228086 0.73 GPR84 (0.42) LMNAFFAR4FFAR1
SCHEMBL4378421 0.73 GPR84 (0.42) LMNAFFAR4FFAR1

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
JP-11060411-A — — None — — JP disclosed
JP-H1160411-A WOOD PRESERVATIVE NOF CORP 1999-03-02 — — JP disclosed
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