SCHEMBL4358779

SCHEMBL4358779

CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(=O)N1CCC2(CC1)OC(=O)c1cc(F)ccc12

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 16/20 0.52
AVPR1A P37288 2/20 0.51
MDM2 Q00987 1/20 0.47

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
SCHEMBL4358775 1.00 ALOX15 (0.52) ALOX15AVPR1AMDM2
SCHEMBL4360559 0.88 AVPR1A (0.51) ALOX15AVPR1AMDM2
SCHEMBL4357748 0.88 AVPR1A (0.53) AVPR1AMDM2
SCHEMBL4361752 0.88 AVPR1A (0.54) AVPR1A
SCHEMBL4361754 0.88 AVPR1A (0.54) AVPR1A
SCHEMBL4359927 0.88 AVPR1A (0.49) ALOX15AVPR1AMDM2
SCHEMBL4359959 0.88 AVPR1A (0.49) ALOX15AVPR1AMDM2
SCHEMBL4365721 0.87 AVPR1A (0.52) AVPR1AMDM2
SCHEMBL4356625 0.87 AVPR1A (0.52) AVPR1AMDM2
SCHEMBL4369124 0.87 AVPR1A (0.54) AVPR1A

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
US-7629353-B2 Indol-3-yl-carbonyl-spiro-piperidine derivatives as V1a receptor antagonists HOFFMAN-LA ROCHE INC. (US) 2009-12-08 US disclosed
EP-1904477-B1 INDOL-3-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS V1A RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2009-01-21 EP disclosed
US-20080146557-A1 INDOL-3-YL-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS VIa RECEPTOR ANTAGONISTS BISSANTZ CATERINA 2008-06-19 US disclosed
US-7332501-B2 Indol-3-yl-carbonyl-spiro-piperidine derivatives as V1a receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2008-02-19 US disclosed
US-20070027173-A1 Indol-3-yl-carbonyl-spiro-piperidine derivatives as Vla receptor antagonists F. HOFFMANN-LA ROCHE AG (CH) 2007-02-01 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 (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-20070027173-A1 Indol-3-yl-carbonyl-spiro-piperidine derivatives as Vla receptor antagonists AVPR1A, AVPR2, AVPR1B ALOX15 1974/4885AVPR1A 1/4885MDM2 2387/4885
US-20080146557-A1 INDOL-3-YL-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS VIa RECEPTOR ANTAGONISTS AVPR1A, AVPR2, OXTR ALOX15 3850/4885AVPR1A 1/4885MDM2 1610/4885

“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.