SCHEMBL20133816

SCHEMBL20133816

CCc1c(C)cc(C)c(NC(CC)CC)c1C

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 4/20 0.33
NR3C1 P04150 3/20 0.31
PGR P06401 2/20 0.31
NR3C2 P08235 2/20 0.31

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
SCHEMBL22436242 0.78 RAPGEF4 (0.42)
SCHEMBL28166915 0.72 PGK1 (0.46)
SCHEMBL9628918 0.68 PGK1 (0.38)
SCHEMBL18966310 0.66 CRHR1 (0.35) CRHR1
SCHEMBL28843526 0.64 PGK1 (0.32)
SCHEMBL28797158 0.64 SLC11A2 (0.39)
SCHEMBL9190327 0.64 PGK1 (0.33)
SCHEMBL12514813 0.63 PGK1 (0.34)
SCHEMBL30523817 0.63 ESR1 (0.41)
SCHEMBL13753712 0.63 ESR1 (0.41)

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
WO-2018089499-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2018-05-10 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-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR CRHR1 4091/4885NR3C1 3435/4885PGR 2174/4885

“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.