SCHEMBL484899

SCHEMBL484899

CC(C)(C)OC(=O)N1CCC2(CCN(c3ccc4cnccc4c3)CC2)C1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.60
ACACB O00763 5/20 0.47
NAMPT P43490 7/20 0.47
HIF1A Q16665 3/20 0.45
GPR119 Q8TDV5 1/20 0.44
CYP2C9 P11712 4/20 0.44
CYP2D6 P10635 3/20 0.44
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SCD5 Q86SK9 1/20 0.44
CYP3A4 P08684 2/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
CYP11B1 P15538 1/20 0.42

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
SCHEMBL2801194 0.86 GPR119 (0.53) NAMPTGPR119TSHRALDH1A1SMN1; SMN2
SCHEMBL485507 0.84 ITGB3 (0.47) HIF1ACYP2C9CYP2D6TSHRALDH1A1
SCHEMBL484102 0.84 HIF1A (0.63) CYP11B2HIF1ACYP2C9CYP2D6TSHR
SCHEMBL484816 0.82 GPR119 (0.65) CYP11B2ACACBNAMPTHIF1AGPR119
SCHEMBL2419062 0.82 GPR119 (0.53) NAMPTGPR119TSHRALDH1A1SMN1; SMN2
SCHEMBL1779308 0.79 MAPK1 (0.55) CYP11B2NAMPTHIF1AGPR119CYP2C9
SCHEMBL13156810 0.79 CYP11B2 (0.61) CYP11B2ACACBNAMPTHIF1AGPR119
SCHEMBL30984892 0.79 ACACB (0.55) CYP11B2ACACBNAMPTSCD5CYP3A4
SCHEMBL30985209 0.79 CYP11B2 (0.56) CYP11B2ACACBNAMPTSCD5CYP11B1
SCHEMBL30042024 0.78 CYP3A4 (0.67) CYP11B2HIF1ACYP2C9CYP2D6TSHR

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-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
EP-2411381-A1 SUBSTITUTED SPIRO-AMIDE COMPOUNDS Grünenthal GmbH (DE) 2012-02-01 EP 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 CYP11B2 2150/4885ACACB 4258/4885NAMPT 2232/4885
US-20100249095-A1 Substituted Spiro-amide Compounds BDKRB1, BDKRB2, REN CYP11B2 2150/4885ACACB 4258/4885NAMPT 2232/4885

“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.