SCHEMBL9948880

SCHEMBL9948880

CC(C)(C)OC(=O)NC1C2CC3CC1CC(NC(=O)O)(C3)C2

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
MAPK1 P28482 1/20 0.53
KMT2A Q03164 1/20 0.53
HSD11B1 P28845 10/20 0.48
EPHX2 P34913 4/20 0.44
CACNA1H O95180 1/20 0.42
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
BTK Q06187 1/20 0.39
HSD11B2 P80365 2/20 0.38

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
SCHEMBL14935729 0.85 MEN1 (0.58) MEN1MAPK1KMT2AHSD11B1EPHX2
SCHEMBL12578947 0.81 HSD11B1 (0.56) MEN1MAPK1KMT2AHSD11B1BTK
SCHEMBL1847058 0.81 HSD11B1 (0.56) MEN1MAPK1KMT2AHSD11B1BTK
SCHEMBL974114 0.81 HSD11B1 (0.56) MEN1MAPK1KMT2AHSD11B1BTK
SCHEMBL1847057 0.81 HSD11B1 (0.56) MEN1MAPK1KMT2AHSD11B1BTK
SCHEMBL974112 0.81 HSD11B1 (0.56) MEN1MAPK1KMT2AHSD11B1BTK
SCHEMBL974113 0.81 HSD11B1 (0.56) MEN1MAPK1KMT2AHSD11B1BTK
SCHEMBL13698839 0.80 MEN1 (0.44) MEN1MAPK1KMT2AHSD11B1EPHX2
SCHEMBL943516 0.80 HSD11B1 (0.56) MEN1MAPK1KMT2AHSD11B1EPHX2
SCHEMBL973696 0.80 EPHX2 (0.45) MEN1MAPK1KMT2AHSD11B1EPHX2

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-8536173-B2 Tetrahydroquinoxaline urea derivatives as modulators of 11-B-hydroxysteroid dehydrogenase type I SANOFI (FR) 2013-09-17 US disclosed
US-20120165337-A1 TETRAHYDROQUINOXALINE UREA DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-06-28 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-20120165337-A1 TETRAHYDROQUINOXALINE UREA DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF NR2C2, CBR3, NR0B2 MEN1 3029/4885MAPK1 3338/4885KMT2A 979/4885

“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.