SCHEMBL26810948

SCHEMBL26810948

COc1ccccc1-c1cc(Oc2ccccc2)nc(NS(=O)(=O)c2ccccc2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ KDM1A O60341 1/20 0.47
▸ CDK9 P50750 5/20 0.46
▸ CCNT1 O60563 4/20 0.46
▸ PGR P06401 4/20 0.46
▸ AURKA O14965 1/20 0.45
▸ MAP4K4 O95819 1/20 0.45
▸ ABL1 P00519 1/20 0.45
▸ LCK P06239 1/20 0.45
▸ MET P08581 1/20 0.45
▸ PDGFRB P09619 1/20 0.45
▸ FGFR1 P11362 1/20 0.45
▸ FLT1 P17948 1/20 0.45
▸ KDR P35968 1/20 0.45
▸ FLT3 P36888 1/20 0.45
▸ MAPK8 P45983 1/20 0.45
▸ MAPK9 P45984 1/20 0.45
▸ GSK3A P49840 1/20 0.45
▸ GSK3B P49841 1/20 0.45

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
SCHEMBL26810832 0.93 TSHR (0.50) TSHRSMN1; SMN2KDM1ACDK9PGR
SCHEMBL24310012 0.88 TSHR (0.46) TSHRSMN1; SMN2CDK9CCNT1PGR
SCHEMBL29566878 0.88 TSHR (0.46) TSHRSMN1; SMN2CDK9CCNT1PGR
SCHEMBL26810957 0.86 TSHR (0.54) TSHRSMN1; SMN2PGRNAT1HPGD
SCHEMBL26810809 0.86 PTGDR2 (0.48) TSHRSMN1; SMN2PGRTHRBLMNA
SCHEMBL26811119 0.85 SCN9A (0.44) TSHRSMN1; SMN2PGRNAT1HPGD
SCHEMBL26810825 0.85 TSHR (0.51) TSHRSMN1; SMN2PGRKDM4ELMNA
SCHEMBL26811084 0.85 MAPT (0.50) TSHRSMN1; SMN2PGRNAT1HPGD
SCHEMBL26810769 0.84 TSHR (0.50) TSHRSMN1; SMN2PGRNAT1HPGD
SCHEMBL26810785 0.84 TSHR (0.48) TSHRSMN1; SMN2KDM1APGRNAT1

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 TSHR 1755/4885SMN1; SMN2 4847/4885KDM1A 4709/4885

“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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