SCHEMBL20468942

SCHEMBL20468942

Cc1cc(N2CCC3(CCN(C(=O)OC(C)(C)C)C3)C2)ccn1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 7/20 0.50
CYP2C9 P11712 5/20 0.50
CYP2D6 P10635 3/20 0.50
CYP11B2 P19099 1/20 0.50
SCD5 Q86SK9 1/20 0.48
ACACB O00763 5/20 0.47
TSHR P16473 5/20 0.44
CYP2C19 P33261 4/20 0.44
CYP1A2 P05177 3/20 0.44
HIF1A Q16665 2/20 0.44
WNT3A P56704 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HSD17B10 Q99714 2/20 0.43
RET P07949 1/20 0.43
HPGD P15428 1/20 0.43
GPR183 P32249 1/20 0.43

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
SCHEMBL12811247 0.88 EGLN2 (0.48) CYP11B2SCD5ACACBTSHRWNT3A
SCHEMBL20468955 0.87 CYP3A4 (0.51) CYP3A4CYP2C9CYP2D6CYP11B2SCD5
SCHEMBL21711129 0.86 CYP11B2 (0.53) CYP3A4CYP2C9CYP2D6CYP11B2SCD5
SCHEMBL20469135 0.86 CYP11B2 (0.53) CYP3A4CYP2C9CYP2D6CYP11B2SCD5
SCHEMBL30328547 0.86 CYP11B2 (0.48) CYP3A4CYP2C9CYP2D6CYP11B2SCD5
SCHEMBL20468954 0.86 CYP11B2 (0.48) CYP3A4CYP2C9CYP2D6CYP11B2SCD5
SCHEMBL30042024 0.85 CYP3A4 (0.67) CYP3A4CYP2C9CYP2D6CYP11B2TSHR
SCHEMBL20468949 0.83 CYP11B2 (0.53) CYP3A4CYP2C9CYP2D6CYP11B2SCD5
SCHEMBL8511634 0.83 CYP11B2 (0.53) CYP3A4CYP2C9CYP2D6CYP11B2SCD5
SCHEMBL20468940 0.82 CYP11B2 (0.53) CYP3A4CYP2C9CYP2D6CYP11B2SCD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200048267-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2020-02-13 US disclosed
WO-2018141984-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2018-08-09 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 (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-20200048267-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN CYP3A4 4278/4885CYP2C9 4183/4885CYP2D6 4092/4885

“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.