SCHEMBL20133629

SCHEMBL20133629

COc1ccc(CN2CCN(c3ccccc3)C(C)(C)C2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
CLPP Q16740 1/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
OPRM1 P35372 4/20 0.43
OPRL1 P41146 4/20 0.43
GRM2 Q14416 1/20 0.43
LMNA P02545 1/20 0.43
HDAC1 Q13547 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
CMA1 P23946 1/20 0.42

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
SCHEMBL3553036 0.76 GAA (0.59) GAASIGMAR1KMT2AMEN1OPRM1
SCHEMBL20133744 0.74 SIGMAR1 (0.51) GAASIGMAR1CLPPKMT2AMEN1
SCHEMBL20149768 0.74 SIGMAR1 (0.62) SIGMAR1KMT2A
SCHEMBL20133631 0.72 SIGMAR1 (0.49) GAASIGMAR1KMT2AMEN1GRM2
SCHEMBL23794645 0.72 GAA (0.55) GAASIGMAR1KMT2AMEN1OPRM1
SCHEMBL18819768 0.72 GAA (0.55) GAASIGMAR1KMT2AMEN1OPRM1
SCHEMBL18821250 0.72 GAA (0.55) GAASIGMAR1KMT2AMEN1OPRM1
SCHEMBL18821265 0.72 GAA (0.51) GAASIGMAR1KMT2AMEN1OPRM1
SCHEMBL23794658 0.72 GAA (0.51) GAASIGMAR1KMT2AMEN1OPRM1
SCHEMBL18821249 0.72 GAA (0.51) GAASIGMAR1KMT2AMEN1OPRM1

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
US-10844013-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2020-11-24 US disclosed
US-20200207716-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2020-07-02 US disclosed
EP-3538091-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF Navitor Pharmaceuticals, Inc. (US) 2019-09-18 EP disclosed
US-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2019-09-17 US disclosed
WO-2018089499-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed
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 (4 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-10844013-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof MTOR, RICTOR, RPTOR GAA 1949/4885SIGMAR1 1261/4885CLPP 1843/4885
US-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof MTOR, RICTOR, RPTOR GAA 1949/4885SIGMAR1 1261/4885CLPP 1843/4885
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR GAA 1949/4885SIGMAR1 1261/4885CLPP 1843/4885
US-20200207716-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR GAA 1949/4885SIGMAR1 1261/4885CLPP 1843/4885

“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.