SCHEMBL20469201

SCHEMBL20469201

Cc1cc(CN2CCC3(CCN(C(=O)OC(C)(C)C)C3)C2)cc(C)n1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACACB O00763 5/20 0.50
RORC P51449 1/20 0.48
SCD5 Q86SK9 1/20 0.47
CYP11B2 P19099 1/20 0.46
CYP2D6 P10635 5/20 0.46
CYP3A4 P08684 4/20 0.46
TSHR P16473 4/20 0.46
USP2 O75604 3/20 0.45
CYP1A2 P05177 3/20 0.45
HPGD P15428 1/20 0.45
GLA P06280 1/20 0.45
ALDH1A1 P00352 1/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
TNKS O95271 1/20 0.43
PARP1 P09874 1/20 0.43
TNKS2 Q9H2K2 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
SCHEMBL31565342 0.83 CYP3A4 (0.60) CYP2D6CYP3A4TSHRUSP2CYP1A2
SCHEMBL1426231 0.83 CYP2D6 (0.64) SCD5CYP2D6CYP3A4TSHRUSP2
SCHEMBL21276348 0.82 MGLL (0.53) RORCCYP2D6CYP3A4TSHRUSP2
SCHEMBL30620506 0.81 GPR183 (0.52) RORCSCD5CYP11B2CYP2D6CYP3A4
SCHEMBL21711129 0.81 CYP11B2 (0.53) ACACBSCD5CYP11B2CYP2D6CYP3A4
SCHEMBL20469135 0.81 CYP11B2 (0.53) ACACBSCD5CYP11B2CYP2D6CYP3A4
SCHEMBL20556708 0.81 ERN1 (0.56) RORCCYP2D6CYP3A4TSHRCYP1A2
SCHEMBL20468833 0.80 RORC (0.47) ACACBRORCSCD5CYP11B2CYP2D6
SCHEMBL20468832 0.79 CYP11B2 (0.52) ACACBRORCSCD5CYP11B2CYP3A4
SCHEMBL19838241 0.78 CYP3A4 (0.66) CYP2D6CYP3A4TSHRUSP2CYP1A2

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 ACACB 639/4885RORC 4866/4885SCD5 1478/4885

“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.