SCHEMBL24253856

SCHEMBL24253856

Nc1nc(O[C@@H]2CCCOC2)cc(N2CCC3(CCCC(=O)N3c3ccc(F)c(F)c3)CC2)n1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TPH1 P17752 3/20 0.32
EP300 Q09472 1/20 0.32
AKT1 P31749 1/20 0.32
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
PDE10A Q9Y233 1/20 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
SCHEMBL30423590 1.00 TPH1 (0.32) TPH1EP300AKT1PIK3CAMTOR
SCHEMBL24253951 0.91 PDE10A (0.37) TPH1EP300AKT1PIK3CAMTOR
SCHEMBL30423914 0.91 PDE10A (0.37) TPH1EP300AKT1PIK3CAMTOR
SCHEMBL30494535 0.89 TPH1 (0.32) TPH1EP300
SCHEMBL24253559 0.89 TPH1 (0.32) TPH1EP300
SCHEMBL30423993 0.87 TPH1 (0.34) TPH1EP300PDE10A
SCHEMBL24253733 0.87 PDE10A (0.33) EP300AKT1PIK3CAMTORPDE10A
SCHEMBL24253945 0.87 PDE10A (0.33) EP300AKT1PIK3CAMTORPDE10A
SCHEMBL30424133 0.87 PDE10A (0.33) EP300AKT1PIK3CAMTORPDE10A
SCHEMBL24253623 0.86 TPH1 (0.35) TPH1EP300

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11708366-B2 Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof NOVARTIS AG (CH) 2023-07-25 US disclosed
US-11708366-B2 Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof NOVARTIS AG (CH) 2023-07-25 US disclosed
US-20220048909-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2022-02-17 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 (2 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-11708366-B2 Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof REN, NR3C2, PKD1 TPH1 3142/4885EP300 1224/4885AKT1 1401/4885
US-20220048909-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF REN, NR3C2, PKD1 TPH1 3142/4885EP300 1224/4885AKT1 1401/4885

“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.