SCHEMBL3516017

SCHEMBL3516017

O=C(O)CCCC(S)CCCS

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 6/20 0.58
▸ ENPEP Q07075 6/20 0.52
▸ GSTK1 Q9Y2Q3 2/20 0.52
▸ LMNA P02545 2/20 0.43
▸ SLC22A6 Q4U2R8 1/20 0.43
▸ ANPEP P15144 3/20 0.43
▸ TSHR P16473 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ PMP22 Q01453 1/20 0.42

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
SCHEMBL3517117 0.93 FOLH1 (0.62) FOLH1ENPEPGSTK1LMNASLC22A6
SCHEMBL3521467 0.91 FOLH1 (0.60) FOLH1ENPEPGSTK1LMNASLC22A6
SCHEMBL18422675 0.91 FOLH1 (0.60) FOLH1ENPEPGSTK1LMNATSHR
SCHEMBL3521389 0.91 FOLH1 (0.52) FOLH1ENPEPGSTK1LMNASLC22A6
SCHEMBL3517277 0.91 FOLH1 (0.61) FOLH1ENPEPGSTK1ANPEP
SCHEMBL11797545 0.86 FOLH1 (0.52) FOLH1ENPEPGSTK1LMNASLC22A6
SCHEMBL3515557 0.84 FOLH1 (0.62) FOLH1ENPEPGSTK1ANPEP
Dihydrolipoic Acid SCHEMBL1115003 0.84 FOLH1 (0.56) FOLH1ENPEPGSTK1LMNASLC22A6
Dihydrolipoic Acid SCHEMBL867951 0.84 FOLH1 (0.56) FOLH1ENPEPGSTK1LMNASLC22A6
Dihydrolipoic Acid SCHEMBL618576 0.84 FOLH1 (0.56) FOLH1ENPEPGSTK1LMNASLC22A6

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
US-20100190902-A1 ALKYLTIN SULFANYL ESTER THIOLS CHEMTURA CORPORATION (US) 2010-07-29 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100190902-A1 ALKYLTIN SULFANYL ESTER THIOLS SULT1E1, SULT1A1, TST FOLH1 4882/4885ENPEP 3338/4885GSTK1 351/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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