SCHEMBL3832389

SCHEMBL3832389

COC(=O)c1ccc(C2SCC(C(=O)O)N2C(=O)OCc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ FFAR2 O15552 4/20 0.49
▸ POLB P06746 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ GAA P10253 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ KDM4E B2RXH2 1/20 0.45
▸ HTR2C P28335 1/20 0.44
▸ MITF O75030 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ SMN1; SMN2 Q16637 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
SCHEMBL3832394 1.00 MEN1 (0.52) MEN1KMT2AFFAR2POLBRAB9A
SCHEMBL3829921 0.89 POLB (0.51) MEN1KMT2AFFAR2POLBRAB9A
SCHEMBL3829924 0.89 POLB (0.51) MEN1KMT2AFFAR2POLBRAB9A
SCHEMBL3827517 0.89 FFAR2 (0.46) MEN1KMT2AFFAR2POLBRAB9A
SCHEMBL3827512 0.89 FFAR2 (0.46) MEN1KMT2AFFAR2POLBRAB9A
SCHEMBL3831328 0.88 HSD17B10 (0.59) FFAR2POLBRAB9AGAAHSD17B10
SCHEMBL3831329 0.88 HSD17B10 (0.59) FFAR2POLBRAB9AGAAHSD17B10
SCHEMBL3826091 0.87 GAA (0.66) MEN1KMT2AFFAR2POLBRAB9A
SCHEMBL3826090 0.87 GAA (0.66) MEN1KMT2AFFAR2POLBRAB9A
SCHEMBL3832317 0.85 HSD17B10 (0.51) MEN1KMT2AFFAR2POLBRAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2099778-A2 AMIDO ANTI-VIRAL COMPOUNDS Smithkline Beecham Corporation (US) 2009-09-16 — — EP disclosed
US-20080181866-A1 Amido Anti-viral Compounds GENELABS TECHNOLOGIES, INC. 2008-07-31 — — US disclosed
WO-2008064218-A2 AMIDO ANTI-VIRAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-05-29 — — WO 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-20080181866-A1 Amido Anti-viral Compounds ZC3HAV1, U2SURP, ZC3HAV1L MEN1 2167/4885KMT2A 4218/4885FFAR2 3853/4885

“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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