SCHEMBL485186

SCHEMBL485186

CC(C)(C)OC(=O)N1CCC2(CCN(c3ccnc(C(F)(F)F)n3)CC2)C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.53
EIF2AK4 Q9P2K8 4/20 0.49
GPR119 Q8TDV5 3/20 0.48
RET P07949 3/20 0.44
ACACB O00763 3/20 0.43
SCD5 Q86SK9 1/20 0.43
HDAC2 Q92769 1/20 0.42
RIPK1 Q13546 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAP4K4 O95819 1/20 0.41
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40

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
SCHEMBL30328058 0.94 EIF2AK4 (0.53) CYP11B2EIF2AK4GPR119RETACACB
SCHEMBL30328382 0.94 EIF2AK4 (0.51) CYP11B2EIF2AK4GPR119RETACACB
SCHEMBL485185 0.85 RIPK1 (0.44) ACACBRIPK1CYP3A4CYP2D6TSHR
SCHEMBL30328148 0.83 FFAR4 (0.54) CYP11B2EIF2AK4GPR119RETACACB
SCHEMBL30328110 0.82 ACACA (0.42) CYP11B2EIF2AK4GPR119ACACBHDAC2
SCHEMBL3486205 0.81 GPR119 (0.72) GPR119ACACB
SCHEMBL30327937 0.80 CYP11B2 (0.51) CYP11B2EIF2AK4GPR119RETACACB
SCHEMBL3782863 0.80 HRH3 (0.53) CYP11B2EIF2AK4GPR119RETACACB
SCHEMBL484915 0.79 HSD17B10 (0.65) CYP11B2GPR119CYP3A4CYP2D6TSHR
SCHEMBL27226391 0.79 GPR119 (0.70) CYP11B2EIF2AK4GPR119RET

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 2150/4885EIF2AK4 2996/4885GPR119 206/4885
US-20100249095-A1 Substituted Spiro-amide Compounds BDKRB1, BDKRB2, REN CYP11B2 2150/4885EIF2AK4 2996/4885GPR119 206/4885

“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.