SCHEMBL13005000

SCHEMBL13005000

CC(C)(C)OC(=O)N1CCC2(CC1)Cc1ccc(Cl)nc1C2

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.43
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ESR2 Q92731 1/20 0.41
NAMPT P43490 3/20 0.41
ACACB O00763 2/20 0.40
GPR119 Q8TDV5 4/20 0.39
SCD5 Q86SK9 1/20 0.39
ABHD6 Q9BV23 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
STS P08842 1/20 0.38
GPR183 P32249 1/20 0.38

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
SCHEMBL24388975 0.84 GPR119 (0.41) CYP11B2NAMPTACACBGPR119SCD5
SCHEMBL24389031 0.83 TRPV3 (0.42) CYP11B2NAMPTACACBGPR119
SCHEMBL29637622 0.81 ABHD6 (0.36) MEN1KMT2AACACBABHD6
SCHEMBL13004992 0.80 POLB (0.50) CYP11B2POLBNAMPTGPR119SCD5
SCHEMBL21940362 0.80 MEN1 (0.49) POLBMEN1KMT2AESR2GPR119
SCHEMBL29609790 0.79 MAPK1 (0.51) CYP11B2MEN1KMT2ANAMPTGPR119
SCHEMBL23902054 0.79 MAPK1 (0.51) CYP11B2MEN1KMT2ANAMPTGPR119
SCHEMBL22521307 0.77 GPR119 (0.47) CYP11B2POLBNAMPTACACBGPR119
SCHEMBL20511944 0.77 POLB (0.40) CYP11B2POLBMEN1KMT2AGPR119
SCHEMBL24335985 0.76 GPR119 (0.46) ESR2ACACBGPR119SCD5GPR183

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100317679-A1 SUBSTITUTED ARYL-FUSED SPIROCYCLIC AMINES LIGAND PHARMACEUTICALS, INC. (US) 2010-12-16 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 (1 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-20100317679-A1 SUBSTITUTED ARYL-FUSED SPIROCYCLIC AMINES HRH3, HRH4, HRH2 CYP11B2 1079/4885POLB 4334/4885MEN1 2115/4885

“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.