SCHEMBL18702012

SCHEMBL18702012

CC(C)(C)C(=O)N1CC2(CSC2)C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
RIPK1 Q13546 1/20 0.31
HSD11B1 P28845 1/20 0.30

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
SCHEMBL18702133 0.77 HSD11B1 (0.44) EPHX2RIPK1HSD11B1
SCHEMBL21137552 0.77 HSD11B1 (0.41) EPHX2RIPK1HSD11B1
SCHEMBL21991871 0.75 HSD11B1 (0.46) EPHX2RIPK1HSD11B1
SCHEMBL12208870 0.75 EPHX2 (0.33) EPHX2MEN1KMT2ARIPK1HSD11B1
SCHEMBL21358370 0.75 USP2 (0.44) EPHX2
SCHEMBL18702002 0.73 EPHX2 (0.35) EPHX2MEN1KMT2ARIPK1
SCHEMBL17886961 0.73 MEN1 (0.34) EPHX2MEN1KMT2ARIPK1
SCHEMBL21358307 0.73
SCHEMBL20469388 0.72 VNN1 (0.40) EPHX2
SCHEMBL31575292 0.72 LMNA (0.40) EPHX2RIPK1HSD11B1

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-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-04-06 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-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS SPR, QDPR, SRR EPHX2 1398/4885MEN1 4876/4885KMT2A 2884/4885

“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.