SCHEMBL2815355

SCHEMBL2815355

O=C(O)c1ccc2c(c1)CC[C@@H]2NC(=O)c1ccccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 11/20 0.62
TAS1R1 Q7RTX1 11/20 0.62
TAS1R2 Q8TE23 10/20 0.62
ALDH1A1 P00352 2/20 0.61
PYGL P06737 2/20 0.49
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48
HTT P42858 1/20 0.47
PYGM P11217 1/20 0.46
SPTLC2 O15270 1/20 0.46
KCNA5 P22460 1/20 0.46

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
SCHEMBL785412 1.00 TAS1R3 (0.62) TAS1R3TAS1R1TAS1R2ALDH1A1PYGL
SCHEMBL785296 1.00 TAS1R3 (0.62) TAS1R3TAS1R1TAS1R2ALDH1A1PYGL
SCHEMBL485126 0.91 ALDH1A1 (0.61) TAS1R3TAS1R1TAS1R2ALDH1A1PYGL
SCHEMBL484760 0.91 ALDH1A1 (0.61) TAS1R3TAS1R1TAS1R2ALDH1A1PYGL
SCHEMBL785249 0.91 ALDH1A1 (0.61) TAS1R3TAS1R1TAS1R2ALDH1A1PYGL
SCHEMBL784805 0.87 TAS1R3 (0.58) TAS1R3TAS1R1TAS1R2ALDH1A1PDE4A
SCHEMBL2820511 0.87 TAS1R3 (0.58) TAS1R3TAS1R1TAS1R2ALDH1A1PDE4A
SCHEMBL784806 0.87 TAS1R3 (0.58) TAS1R3TAS1R1TAS1R2ALDH1A1PDE4A
SCHEMBL788838 0.84 ALDH1A1 (0.72) TAS1R3TAS1R1TAS1R2ALDH1A1HTT
SCHEMBL785465 0.84 ALDH1A1 (0.72) TAS1R3TAS1R1TAS1R2ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130231327-A1 Substituted Spiro-Amide Compounds GRUENENTHAL GMBH (DE) 2013-09-05 US disclosed
US-20130231327-A1 Substituted Spiro-Amide Compounds GRUENENTHAL GMBH (DE) 2013-09-05 US disclosed
US-20130231327-A1 Substituted Spiro-Amide Compounds GRUENENTHAL GMBH (DE) 2013-09-05 US disclosed
US-8455475-B2 Substituted spiro-amide compounds GRUENENTHAL GMBH (DE) 2013-06-04 US disclosed
US-8455475-B2 Substituted spiro-amide compounds GRUENENTHAL GMBH (DE) 2013-06-04 US disclosed
US-8455475-B2 Substituted spiro-amide compounds GRUENENTHAL GMBH (DE) 2013-06-04 US disclosed
US-20100249095-A1 Substituted Spiro-amide Compounds GRUENENTHAL GMBH (DE) 2010-09-30 US disclosed
US-20100249095-A1 Substituted Spiro-amide Compounds GRUENENTHAL GMBH (DE) 2010-09-30 US disclosed
US-20100249095-A1 Substituted Spiro-amide Compounds GRUENENTHAL GMBH (DE) 2010-09-30 US disclosed
WO-2010108651-A1 SUBSTITUTED SPIRO-AMIDE COMPOUNDS Grünenthal GmbH (DE) 2010-09-30 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 (2 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-20130231327-A1 Substituted Spiro-Amide Compounds BDKRB1, BDKRB2, REN TAS1R3 339/4885TAS1R1 107/4885TAS1R2 282/4885
US-20100249095-A1 Substituted Spiro-amide Compounds BDKRB1, BDKRB2, REN TAS1R3 339/4885TAS1R1 107/4885TAS1R2 282/4885

“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.