SCHEMBL20133631

SCHEMBL20133631

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

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.49
GAA P10253 1/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
GRM2 Q14416 1/20 0.45
LMNA P02545 2/20 0.44
HRH2 P25021 1/20 0.44
TP53 P04637 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM3 P20309 1/20 0.43
HDAC1 Q13547 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
SCHEMBL20129639 0.85 MAPK1 (0.40) GAAKMT2AGRM2LMNA
SCHEMBL20133744 0.77 SIGMAR1 (0.51) SIGMAR1GAAMEN1KMT2ALMNA
SCHEMBL20133629 0.72 GAA (0.49) SIGMAR1GAAMEN1KMT2AGRM2
SCHEMBL20347759 0.72 GAA (0.55) SIGMAR1GAAMEN1KMT2A
SCHEMBL28296992 0.72 MEN1 (0.57) SIGMAR1GAAMEN1KMT2ALMNA
SCHEMBL8913255 0.71 HDAC1 (0.67) SIGMAR1GAAMEN1KMT2ALMNA
Bromide SCHEMBL8567147 0.71 SIGMAR1 (0.47) SIGMAR1GAAMEN1KMT2AHRH2
Bromide SCHEMBL8899316 0.71 SIGMAR1 (0.47) SIGMAR1GAAMEN1KMT2AHRH2
SCHEMBL2262769 0.71 GAA (0.44) SIGMAR1GAAMEN1KMT2AGRM2
SCHEMBL13717039 0.71 GRM2 (0.49) SIGMAR1GAAMEN1KMT2AGRM2

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 SIGMAR1 1261/4885GAA 1949/4885MEN1 3142/4885
US-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof MTOR, RICTOR, RPTOR SIGMAR1 1261/4885GAA 1949/4885MEN1 3142/4885
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR SIGMAR1 1261/4885GAA 1949/4885MEN1 3142/4885
US-20200207716-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR SIGMAR1 1261/4885GAA 1949/4885MEN1 3142/4885

“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.