SCHEMBL26811500

SCHEMBL26811500

CCc1c(Oc2cccc(Cl)c2)nc(NS(=O)(=O)c2cnn(C)c2)nc1-c1ccccc1C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 11/20 0.38
▸ HTR1A P08908 4/20 0.36
▸ HTR7 P34969 4/20 0.36
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ MALT1 Q9UDY8 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL29566629 0.91 GPR119 (0.40) GPR119HTR1AHTR7PTGS1PTGS2
SCHEMBL26808782 0.91 GPR119 (0.40) GPR119HTR1AHTR7PTGS1PTGS2
SCHEMBL26811501 0.91 HTR1A (0.39) GPR119HTR1AHTR7PTGS1PTGS2
SCHEMBL26811481 0.88 HTR2C (0.40) HTR1AHTR7
SCHEMBL26811489 0.87 FGFR1 (0.38) GPR119HTR1AHTR7
SCHEMBL24310357 0.86 HTR1A (0.41) HTR1AHTR7
SCHEMBL29566856 0.86 HTR1A (0.41) HTR1AHTR7
SCHEMBL29566407 0.84 HTR1A (0.38) GPR119HTR1AHTR7PTGS1LMNA
SCHEMBL26812465 0.84 HTR1A (0.38) GPR119HTR1AHTR7PTGS1LMNA
SCHEMBL26811477 0.83 HTR1A (0.39) HTR1AHTR7MALT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373935-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS, SAN DIEGO 2023-11-23 — — US disclosed
US-20230373935-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS, SAN DIEGO 2023-11-23 — — 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-20230373935-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B GPR119 612/4885HTR1A 4018/4885HTR7 3833/4885

“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.

Send feedback