SCHEMBL14769168

SCHEMBL14769168

O=C1N(c2ccc(C3CCC(O)CC3)cc2)CCC12CCCCC2

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.61
EGLN1 Q9GZT9 1/20 0.50
ESR2 Q92731 2/20 0.41
LIPE Q05469 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
KCNH2 Q12809 1/20 0.39

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
SCHEMBL1589768 0.92 HRH3 (0.66) HRH3EGLN1ESR2LIPE
SCHEMBL6137 0.92 HRH3 (0.66) HRH3EGLN1ESR2LIPE
SCHEMBL10308 0.92 HRH3 (0.66) HRH3EGLN1ESR2LIPE
SCHEMBL12185502 0.87 HRH3 (0.73) HRH3EGLN1ESR2KCNH2
SCHEMBL14760991 0.87 HRH3 (0.73) HRH3EGLN1ESR2KCNH2
SCHEMBL14769119 0.82 HRH3 (0.56) HRH3EGLN1LIPE
SCHEMBL12303 0.82 HRH3 (0.62) HRH3EGLN1LIPE
SCHEMBL9671 0.81 HRH3 (0.60) HRH3EGLN1ESR2
SCHEMBL1589959 0.80 HRH3 (0.60) HRH3EGLN1ESR2LIPE
SCHEMBL10149 0.80 HRH3 (0.60) HRH3EGLN1ESR2LIPE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9453023-B2 Substituted phenyl cycloalkyl pyrrolidine (piperidine) spirolactams and amides, preparation and therapeutic use thereof SANOFI (FR) 2016-09-27 US disclosed
US-20140275005-A1 SUBSTITUTED PHENYL CYCLOALKYL PYRROLIDINE (PIPERIDINE) SPIROLACTAMS AND AMIDES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2014-09-18 US disclosed
US-8735385-B2 Substituted phenyl cycloalkyl pyrrolidine (piperidine) spirolactams and amides, preparation and therapeutic use thereof SANOFI (FR) 2014-05-27 US disclosed
US-20130065877-A1 SUBSTITUTED PHENYL CYCLOALKYL PYRROLIDINE (PIPERIDINE) SPIROLACTAMS AND AMIDES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-03-14 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-20130065877-A1 SUBSTITUTED PHENYL CYCLOALKYL PYRROLIDINE (PIPERIDINE) SPIROLACTAMS AND AMIDES, PREPARATION AND THERAPEUTIC USE THEREOF PRLHR, TACR1, TACR2 HRH3 14/4885EGLN1 1662/4885ESR2 832/4885
US-20140275005-A1 SUBSTITUTED PHENYL CYCLOALKYL PYRROLIDINE (PIPERIDINE) SPIROLACTAMS AND AMIDES, PREPARATION AND THERAPEUTIC USE THEREOF PRLHR, TACR1, TACR2 HRH3 14/4885EGLN1 1662/4885ESR2 832/4885

“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.