SCHEMBL142826

SCHEMBL142826

CC(C)(C)OC(=O)NC1(C(=O)Nc2cnccc2O)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.39
CYP17A1 P05093 3/20 0.39
NAMPT P43490 2/20 0.37
BRS3 P32247 1/20 0.37
RAB9A P51151 1/20 0.36
FAAH O00519 1/20 0.34
LATS1 O95835 4/20 0.34
LATS2 Q9NRM7 1/20 0.34
BDKRB1 P46663 2/20 0.33
MAPT P10636 1/20 0.33
GSK3B P49841 1/20 0.33

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
SCHEMBL146430 0.91 GHSR (0.41) GHSRCYP17A1NAMPTBRS3RAB9A
SCHEMBL25890385 0.88 CYP11B1 (0.39) GHSRCYP17A1NAMPTBRS3RAB9A
SCHEMBL26318454 0.80 NAMPT (0.57) GHSRNAMPTRAB9A
SCHEMBL31611248 0.80 NAMPT (0.57) GHSRNAMPTRAB9A
SCHEMBL8346749 0.76 GHSR (0.47) GHSRRAB9AFAAH
SCHEMBL14162121 0.74 GHSR (0.42) GHSRRAB9AFAAHMAPT
SCHEMBL30759275 0.74 NAMPT (0.43) CYP17A1NAMPTBRS3RAB9ALATS1
SCHEMBL143257 0.74 NAMPT (0.32) NAMPTBRS3RAB9ALATS1MAPT
SCHEMBL8344329 0.73 KMT2A (0.50) GHSRRAB9AFAAH
SCHEMBL3489715 0.73 TSHR (0.44) GHSRNAMPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2545051-B1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C BRISTOL MYERS SQUIBB CO (US) 2017-04-19 EP disclosed
US-8354410-B2 Compounds for the treatment of hepatitis C BRISTOL-MEYERS SQUIBB COMPANY (US) 2013-01-15 US disclosed
US-20120059019-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2012-03-08 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-20120059019-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 GHSR 3672/4885CYP17A1 667/4885NAMPT 1820/4885

“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.