SCHEMBL26858387

SCHEMBL26858387

Cc1cccc(C)c1-c1cc(Oc2cccc(N3CCNCC3)c2)nc(NS(=O)(=O)c2cnn(C)c2)n1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GUSB P08236 19/20 0.42
▸ HTR6 P50406 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
SCHEMBL24310583 0.93 RIPK2 (0.38) GUSBHTR6
SCHEMBL24310014 0.92 HTR1A (0.42) GUSBHTR6
SCHEMBL26809994 0.91 GUSB (0.36) GUSBHTR6
SCHEMBL26808265 0.90 HTR3E (0.39) GUSBHTR6
SCHEMBL29566284 0.90 HTR3E (0.39) GUSBHTR6
SCHEMBL29567188 0.90 HTR6 (0.37) GUSBHTR6
SCHEMBL24310372 0.90 HTR6 (0.37) GUSBHTR6
SCHEMBL26806483 0.90 ALOX12 (0.39) —
SCHEMBL29567043 0.89 HTR6 (0.37) GUSBHTR6
SCHEMBL26837336 0.89 HTR6 (0.37) GUSBHTR6

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-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 GUSB 2723/4885HTR6 2653/4885

“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.

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