SCHEMBL8298976

SCHEMBL8298976

Cc1cccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)c1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.70
HSD11B1 P28845 3/20 0.61
CYP17A1 P05093 2/20 0.61
CYP19A1 P11511 2/20 0.61
ALDH1A1 P00352 3/20 0.59
KMT2A Q03164 2/20 0.59
MEN1 O00255 1/20 0.59
POLB P06746 1/20 0.54
EPHX2 P34913 5/20 0.53
LMNA P02545 1/20 0.51
METAP2 P50579 1/20 0.49

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
SCHEMBL27400280 0.85 HPGD (0.72) HPGDHSD11B1CYP17A1CYP19A1ALDH1A1
SCHEMBL3320998 0.84 HPGD (0.75) HPGDHSD11B1CYP17A1CYP19A1ALDH1A1
SCHEMBL14002183 0.83 HPGD (0.65) HPGDHSD11B1CYP17A1CYP19A1ALDH1A1
SCHEMBL3455848 0.83 HPGD (1.00) HPGDHSD11B1CYP17A1CYP19A1ALDH1A1
SCHEMBL3319980 0.80 HPGD (0.64) HPGDHSD11B1CYP17A1CYP19A1ALDH1A1
SCHEMBL1548543 0.79 HPGD (0.67) HPGDHSD11B1CYP17A1CYP19A1ALDH1A1
SCHEMBL14705916 0.78 ALDH1A1 (0.57) HSD11B1ALDH1A1KMT2AMEN1LMNA
SCHEMBL11736108 0.77 ALDH1A1 (0.65) HPGDHSD11B1CYP17A1CYP19A1ALDH1A1
SCHEMBL11739611 0.77 HPGD (0.77) HPGDHSD11B1CYP17A1CYP19A1ALDH1A1
SCHEMBL4105154 0.76 EPHX2 (0.71) HPGDHSD11B1ALDH1A1EPHX2

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-12017974-B2 Adamantanecarboxylic acid benzyl amide derivative compound and skin whitening composition comprising same AMOREPACIFIC CORPORATION (KR) 2024-06-25 US disclosed
WO-2005012304-A2 TRIAZOLOPYRIMIDINE DERIVATIVES AS GLYCOGEN SYNTHASE KINASE 3 INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-10 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-12017974-B2 Adamantanecarboxylic acid benzyl amide derivative compound and skin whitening composition comprising same TYR, DDC, AANAT HPGD 555/4885HSD11B1 1164/4885CYP17A1 1396/4885

“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.