SCHEMBL19798652

SCHEMBL19798652

CC(C)(C)C1C2CC3CC1CC(O)(C3)C2

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 15/20 0.43
HSD11B2 P80365 2/20 0.43
EPHX2 P34913 1/20 0.34

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
SCHEMBL10234486 0.78 HSD11B1 (0.40) HSD11B1HSD11B2EPHX2
SCHEMBL12968026 0.78 HSD11B1 (0.40) HSD11B1HSD11B2EPHX2
SCHEMBL28067763 0.77 HSD11B1 (0.43) HSD11B1HSD11B2EPHX2
SCHEMBL482354 0.75 HSD11B1 (0.39) HSD11B1HSD11B2EPHX2
SCHEMBL19798655 0.75
SCHEMBL19075611 0.74
Ammonia Solution, Strong SCHEMBL28328924 0.73 HSD11B1 (0.38) HSD11B1HSD11B2EPHX2
SCHEMBL12765789 0.72 EPHX2 (0.37) HSD11B1HSD11B2EPHX2
SCHEMBL12837800 0.72 CYP2C9 (0.39) HSD11B1HSD11B2EPHX2
SCHEMBL1772242 0.72 CYP2C9 (0.46) HSD11B1HSD11B2EPHX2

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-20180022752-A1 FUSED-RING COMPOUNDS, PHARMACEUTICAL COMPOSITION AND USES THEREOF Shanghai De Novo Pharmatech Co., Ltd. (CN) 2018-01-25 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-20180022752-A1 FUSED-RING COMPOUNDS, PHARMACEUTICAL COMPOSITION AND USES THEREOF IDO1, IDO2, TDO2 HSD11B1 196/4885HSD11B2 127/4885EPHX2 1124/4885

“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.