SCHEMBL19969161

SCHEMBL19969161

CCN(C(=O)[C@H](Cc1cc(F)cc(F)c1)NS(=O)(=O)CS(=O)(=O)N[C@@H](Cc1cc(F)cc(F)c1)C(=O)N(C)c1ccc2scnc2c1)c1ccc2scnc2c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30

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
SCHEMBL19962152 0.94 PDE10A (0.34) PDE10ATAS1R3TAS1R1
SCHEMBL19962073 0.94 PDE10A (0.30) PDE10A
SCHEMBL19962082 0.87 SYK (0.34) PDE10ATAS1R3TAS1R1
SCHEMBL19969339 0.87 SYK (0.34) PDE10ATAS1R3TAS1R1
SCHEMBL19969193 0.86 PDE10A (0.31) PDE10A
SCHEMBL19969237 0.86 PDE10A (0.31) PDE10A
SCHEMBL18180305 0.84
SCHEMBL19968967 0.84
SCHEMBL18180271 0.81 SYK (0.31) PDE10A
SCHEMBL19969198 0.81 SYK (0.31) PDE10A

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-20180072997-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY 2018-03-15 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-20180072997-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION EIF2AK2, POLR2H, POLR2E PDE10A 2805/4885TAS1R3 4630/4885TAS1R1 4468/4885

“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.