SCHEMBL13630352

SCHEMBL13630352

CCN(CC)C1CCN(C2=NC(=O)/C(=C/c3cc(F)cc(C)c3O)S2)C1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 11/20 0.43
▸ KMT2A Q03164 11/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ PSMD14 O00487 1/20 0.41
▸ AMY1A P0DUB6 1/20 0.39
▸ GAA P10253 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ GRIN1 Q05586 1/20 0.38
▸ GRIN2B Q13224 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HTT P42858 1/20 0.37

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
SCHEMBL13629852 0.90 MEN1 (0.46) MEN1KMT2ANPC1PSMD14AMY1A
SCHEMBL13629853 0.90 MEN1 (0.46) MEN1KMT2ANPC1PSMD14AMY1A
SCHEMBL13629863 0.86 MEN1 (0.46) MEN1KMT2ANPC1PSMD14AMY1A
SCHEMBL13629864 0.85 MEN1 (0.46) MEN1KMT2ANPC1PSMD14AMY1A
SCHEMBL13630619 0.80 MEN1 (0.45) MEN1KMT2ANPC1PSMD14GAA
SCHEMBL13630611 0.80 MEN1 (0.47) MEN1KMT2ANPC1PSMD14GAA
SCHEMBL13616364 0.79 MEN1 (0.43) MEN1KMT2ANPC1PSMD14AMY1A
SCHEMBL13616363 0.79 MEN1 (0.43) MEN1KMT2ANPC1PSMD14AMY1A
SCHEMBL13630616 0.79 NPC1 (0.45) MEN1KMT2ANPC1PSMD14GFER
SCHEMBL13747638 0.76 MEN1 (0.41) MEN1KMT2ANPC1PSMD14AMY1A

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-20090275538-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS UNIVERSITE LAVAL (CA) 2009-11-05 — — US disclosed
WO-2009097695-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS CHLORION PHARMA, INC. (CA) 2009-08-13 — — 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-20090275538-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS OPRL1, OPRK1, AHR MEN1 4697/4885KMT2A 1752/4885NPC1 2712/4885

“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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