SCHEMBL20133686

SCHEMBL20133686

CNC(=O)c1cccnc1N1CCNC[C@H]1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.46
HTR2C P28335 3/20 0.46
HTR2B P41595 3/20 0.46
KMT2A Q03164 2/20 0.41
BRPF1 P55201 2/20 0.41
BRD4 O60885 1/20 0.41
BRD1 O95696 1/20 0.41
BRPF3 Q9ULD4 1/20 0.41
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
CHIA Q9BZP6 1/20 0.40
HTR3A P46098 1/20 0.40
ADRA1D P25100 1/20 0.38
ADRA1A P35348 1/20 0.38
ADRA1B P35368 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
GSK3B P49841 4/20 0.37

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
SCHEMBL20141187 0.78 SMO (0.45) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL24640111 0.77 HRH3 (0.42) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL13931360 0.76 HTR2C (0.53) HTR2AHTR2CHTR2B
SCHEMBL2419267 0.76 HTR2A (0.53) HTR2AHTR2CHTR2BGSK3B
SCHEMBL6219727 0.76 HTR2A (0.53) HTR2AHTR2CHTR2BGSK3B
Ammonia Solution, Strong SCHEMBL27277144 0.75 CYP1A2 (0.51) HTR2AHTR2CHTR2BKMT2AMEN1
SCHEMBL9206909 0.74 HTR2C (0.51) HTR2AHTR2CHTR2BBRPF1BRD4
SCHEMBL20140940 0.73 HTR2A (0.48) HTR2AHTR2CHTR2BKMT2AMEN1
SCHEMBL20129660 0.73 HTR2A (0.48) HTR2AHTR2CHTR2BKMT2AMEN1
SCHEMBL3331400 0.73 HTR2C (0.50) HTR2AHTR2CHTR2BALDH1A1

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 4 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
US-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2019-09-17 US 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 HTR2A 2343/4885HTR2C 1236/4885HTR2B 2265/4885
US-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof MTOR, RICTOR, RPTOR HTR2A 2343/4885HTR2C 1236/4885HTR2B 2265/4885
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR HTR2A 2343/4885HTR2C 1236/4885HTR2B 2265/4885
US-20200207716-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR HTR2A 2343/4885HTR2C 1236/4885HTR2B 2265/4885

“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.