SCHEMBL17535385

SCHEMBL17535385

CCOc1cc(CO)nc(C2CC2)c1OCOC

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
FPR2 P25090 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NTSR1 P30989 1/20 0.31
S1PR1 P21453 2/20 0.31
S1PR3 Q99500 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL17535789 0.79 POLB (0.33) LMNATP53MAPTMEN1KMT2A
SCHEMBL17535464 0.77 LMNA (0.33) LMNATP53MAPT
SCHEMBL11041790 0.67 MEN1 (0.43) LMNAMEN1KMT2ATSHR
SCHEMBL17150153 0.63 TRPV3 (0.38) MAPTFPR2S1PR1S1PR3
SCHEMBL23459828 0.62 PRKAA2 (0.41) LMNAMAPTFPR2MEN1KMT2A
SCHEMBL21749946 0.62 S1PR1 (0.44) TP53MAPTS1PR1S1PR3TSHR
SCHEMBL17536023 0.61 LMNA (0.31) LMNATP53MAPT
SCHEMBL23202761 0.61 HSD17B10 (0.41) MAPTMEN1KMT2ATSHR
SCHEMBL17535321 0.61 ALDH1A1 (0.33)
SCHEMBL6608408 0.60 PDE4A (0.36) MAPTS1PR1

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 LMNA 4589/4885TP53 2361/4885MAPT 3594/4885

“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.