SCHEMBL9982233

SCHEMBL9982233

O=CNC1C2CC3CC1CC(O)(C3)C2

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 15/20 0.43
HSD11B2 P80365 2/20 0.43
EPHX2 P34913 2/20 0.40
DPP4 P27487 1/20 0.36

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
SCHEMBL233311 0.77 HSD11B1 (0.44) HSD11B1HSD11B2
SCHEMBL13223479 0.74 GRIN2D (0.52) EPHX2
SCHEMBL942696 0.74 HSD11B1 (0.46) HSD11B1HSD11B2EPHX2
SCHEMBL10046792 0.74 HSD11B1 (0.46) HSD11B1HSD11B2EPHX2
SCHEMBL16380619 0.74 HSD11B1 (0.46) HSD11B1HSD11B2EPHX2DPP4
SCHEMBL10046791 0.74 HSD11B1 (0.46) HSD11B1HSD11B2EPHX2
SCHEMBL27509398 0.74 HSD11B1 (0.36) HSD11B1HSD11B2EPHX2DPP4
SCHEMBL12968026 0.73 HSD11B1 (0.40) HSD11B1HSD11B2EPHX2DPP4
SCHEMBL10234486 0.73 HSD11B1 (0.40) HSD11B1HSD11B2EPHX2DPP4
SCHEMBL3041989 0.73 HSD11B1 (0.54) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2238126-B1 DERIVATIVES OF TETRAHYDROQUINOXALINE UREA, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI SA (FR) 2014-11-05 EP claimed
US-8211892-B2 Tetrahydroquinoxaline urea derivatives SANOFI-AVENTIS (FR) 2012-07-03 US claimed
CN-110305123-A A kind of compound containing adamantane and its purposes in treating cancer 成都海创药业有限公司 2019-10-08 CN disclosed
US-8530657-B2 Substituted adamantanes and their therapeutic application SANOFI (FR) 2013-09-10 US disclosed
US-20120245148-A1 TETRAHYDROQUINOXALINE UERA DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2012-09-27 US disclosed
US-8211892-B2 Tetrahydroquinoxaline urea derivatives SANOFI-AVENTIS (FR) 2012-07-03 US disclosed
US-8017638-B2 Isoxazole derivative and isothiazole derivative having inhibitory activity on 11β-hydroxysteroid dehydrogenase type 1 SHIONOGI & CO., LTD. (JP) 2011-09-13 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-20120245148-A1 TETRAHYDROQUINOXALINE UERA DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION UGDH, HNMT, NNMT HSD11B1 2913/4885HSD11B2 3024/4885EPHX2 956/4885

“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.