SCHEMBL26807485

SCHEMBL26807485

Cn1cc(S(=O)(=O)Nc2nc(Oc3ccccc3)cc(C3CCC(C(F)(F)F)CC3)n2)cn1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 6/20 0.40
▸ HTR7 P34969 6/20 0.40
▸ SLC8A1 P32418 1/20 0.36
▸ TSHR P16473 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ GPR119 Q8TDV5 2/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ HTR6 P50406 1/20 0.34
▸ JAK1 P23458 1/20 0.34
▸ PCK1 P35558 1/20 0.33
▸ GPR39 O43194 1/20 0.33
▸ SCN9A Q15858 2/20 0.33
▸ BCDIN3D Q7Z5W3 1/20 0.33
▸ NTRK1 P04629 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ KDR P35968 1/20 0.33

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
SCHEMBL26807484 0.89 HTR1A (0.43) HTR1AHTR7SLC8A1TSHRSMN1; SMN2
SCHEMBL26807354 0.88 HTR1A (0.42) HTR1AHTR7SLC8A1TSHRSMN1; SMN2
SCHEMBL29566649 0.88 HTR1A (0.42) HTR1AHTR7SLC8A1TSHRSMN1; SMN2
SCHEMBL26810991 0.88 TSHR (0.43) TSHRSMN1; SMN2GPR119GPR39
SCHEMBL24309397 0.87 HTR1A (0.40) HTR1AHTR7SLC8A1TSHRSMN1; SMN2
SCHEMBL26807482 0.87 HTR1A (0.40) HTR1AHTR7SLC8A1TSHRSMN1; SMN2
SCHEMBL29566328 0.87 HTR1A (0.40) HTR1AHTR7SLC8A1TSHRSMN1; SMN2
SCHEMBL26807495 0.83 HTR1A (0.38) HTR1AHTR7SLC8A1TSHRSMN1; SMN2
SCHEMBL26807486 0.82 HTR1A (0.41) HTR1AHTR7SLC8A1TSHRSMN1; SMN2
SCHEMBL26807483 0.80 HTR1A (0.41) HTR1AHTR7SLC8A1TSHRSMN1; 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 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 HTR1A 4018/4885HTR7 3833/4885SLC8A1 201/4885

“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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