SCHEMBL22693232

SCHEMBL22693232

C#C/C=C(C(\C#N)=C/C)/N1CCC(Nc2cc(C(=O)N3CCN(c4ccccn4)CC3)c(C)cc2C)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MTOR P42345 4/20 0.47
RPTOR Q8N122 4/20 0.47
MLST8 Q9BVC4 4/20 0.47
ALDH1A1 P00352 7/20 0.46
KDM4E B2RXH2 6/20 0.43
ATM Q13315 1/20 0.43
HSD17B10 Q99714 3/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 2/20 0.42
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL22693157 0.89 MTOR (0.49) MTORRPTORMLST8ALDH1A1KDM4E
SCHEMBL22693268 0.88 MTOR (0.49) MTORRPTORMLST8ALDH1A1TSHR
SCHEMBL22693184 0.86 MTOR (0.45) MTORRPTORMLST8ALDH1A1KDM4E
SCHEMBL22693170 0.85 MTOR (0.54) MTORRPTORMLST8ALDH1A1KDM4E
SCHEMBL22693225 0.85 MTOR (0.54) MTORRPTORMLST8ALDH1A1KDM4E
SCHEMBL22693236 0.83 MTOR (0.51) MTORRPTORMLST8ALDH1A1KDM4E
SCHEMBL22693180 0.83 MTOR (0.56) MTORRPTORMLST8ALDH1A1KDM4E
SCHEMBL22693096 0.81 MTOR (0.43) MTORRPTORMLST8
SCHEMBL22693231 0.80 MTOR (0.43) MTORRPTORMLST8SMN1; SMN2
SCHEMBL22693230 0.80 MTOR (0.43) MTORRPTORMLST8MAPTSMN1; SMN2

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 1 patent. 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

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-10844013-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof MTOR, RICTOR, RPTOR MTOR 1/4885RPTOR 3/4885MLST8 7/4885

“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.