SCHEMBL17535540

SCHEMBL17535540

COC(=O)c1cc(Br)c(N2CCC(O[Si](C)(C)C(C)(C)C)CC2)cc1OC

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 15/20 0.37
NR1I2 O75469 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL17535415 0.87 NR1I2 (0.35) OPRK1NR1I2KDM4ENPC1ALDH1A1
SCHEMBL17535322 0.81 HIF1A (0.40) KDM4EALDH1A1MAPT
SCHEMBL16055145 0.77 RAB9A (0.49) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL30783797 0.75 SCD (0.39) MAPT
SCHEMBL1665317 0.73 NPC1 (0.49) KDM4ENPC1ALDH1A1MAPTHPGD
SCHEMBL17535813 0.73 WHR1 (0.38) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL30783763 0.71 SCD (0.36) ALDH1A1MAPT
SCHEMBL30762524 0.71 SCD (0.39)
SCHEMBL30783866 0.71 TSHR (0.36) KDM4EALDH1A1MAPTHPGD
SCHEMBL16055167 0.70 MAPT (0.32) ALDH1A1MAPT

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-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

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 OPRK1 1046/4885NR1I2 1533/4885KDM4E 3566/4885

“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.