SCHEMBL16055437

SCHEMBL16055437

COC(=O)c1ccc(N2CCC3(CC2)OCCO3)cc1OC(C)C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 3/20 0.41
▸ MKNK1 Q9BUB5 2/20 0.40
▸ MKNK2 Q9HBH9 2/20 0.40
▸ PRKDC P78527 1/20 0.40
▸ POLB P06746 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ LGMN Q99538 1/20 0.40
▸ PTGDR Q13258 1/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ALK Q9UM73 1/20 0.38
▸ SIRT6 Q8N6T7 1/20 0.38
▸ RAB9A P51151 2/20 0.37
▸ RXFP1 Q9HBX9 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ MET P08581 1/20 0.37
▸ AXL P30530 1/20 0.37
▸ MEN1 O00255 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
SCHEMBL17893686 0.89 ALDH1A1 (0.47) HIF1APRKDCPOLBALDH1A1LGMN
SCHEMBL16056416 0.86 MEN1 (0.41) HIF1AMKNK1MKNK2ALDH1A1PTGDR
SCHEMBL16056102 0.84 ALDH1A1 (0.49) POLBALDH1A1LGMNKMT2ASMN1; SMN2
SCHEMBL2831091 0.83 SMN1; SMN2 (0.43) POLBALDH1A1KMT2ASMN1; SMN2RAB9A
SCHEMBL26931936 0.82 POLB (0.44) PRKDCPOLBALDH1A1LGMNKMT2A
SCHEMBL17893671 0.82 PRKDC (0.53) PRKDCPOLBALDH1A1LGMNKMT2A
SCHEMBL17893773 0.81 NPC1 (0.44) PRKDCPOLBALDH1A1LGMNKMT2A
SCHEMBL16056390 0.80 HIF1A (0.44) HIF1AMKNK1MKNK2PTGDRKMT2A
SCHEMBL31568638 0.80 LGMN (0.41) PRKDCPOLBALDH1A1LGMNKMT2A
SCHEMBL1958272 0.78 KMT2A (0.42) POLBALDH1A1KMT2ASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970331-B1 SPIRO AZETIDINE ISOXAZOLE DERIVATIVES AND THEIR USE AS SSTR5 ANTAGONISTS TAKEDA PHARMACEUTICALS CO (JP) 2017-05-17 — — EP disclosed
US-9605000-B2 Spiro azetidine isoxazole derivatives and their use as SSTR antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-03-28 — — US disclosed
US-20160060273-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-03-03 — — US disclosed
EP-2970331-A1 SPIRO AZETIDINE ISOXAZOLE DERIVATIVES AND THEIR USE AS SSTR5 ANTAGONISTS Takeda Pharmaceutical Company Limited (JP) 2016-01-20 — — EP disclosed
WO-2014142363-A1 SPIRO AZETIDINE ISOXAZOLE DERIVATIVES AND THEIR USE AS SSTR5 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-09-18 — — 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-20160060273-A1 HETEROCYCLIC COMPOUND SSTR5, SSTR1, SSTR2 HIF1A 1757/4885MKNK1 1191/4885MKNK2 1127/4885

“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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