SCHEMBL24310547

SCHEMBL24310547

O=S(=O)(Nc1nc(Oc2ccccc2)cc(-c2ccccc2)n1)c1cccc(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
HSPD1 P10809 3/20 0.46
PTPN5 P54829 3/20 0.46
HSPE1 P61604 3/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TSHR P16473 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYTH2 Q99418 1/20 0.41
PGR P06401 5/20 0.41
SYK P43405 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GPR39 O43194 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
SCHEMBL26806813 0.89 MAPT (0.61) MAPTMAPK1TDP1MEN1KMT2A
SCHEMBL26812964 0.87 AKR1C3 (0.52) MAPTMAPK1TDP1HSPD1HSPE1
SCHEMBL26812958 0.87 MAPT (0.48) MAPTMAPK1TDP1MEN1KMT2A
SCHEMBL24310185 0.86 PGR (0.58) MAPTMAPK1TDP1HSPD1PTPN5
SCHEMBL24310182 0.86 MAPT (0.59) MAPTMAPK1TDP1MEN1KMT2A
SCHEMBL26812980 0.86 MAPT (0.50) MAPTMAPK1TDP1MEN1KMT2A
SCHEMBL24310603 0.84 MAPT (0.47) MAPTMAPK1TDP1MEN1KMT2A
SCHEMBL26812984 0.84 PGR (0.60) MAPTMAPK1TDP1HSPD1PTPN5
SCHEMBL26811138 0.83 MAPT (0.49) MAPTMAPK1TDP1MEN1KMT2A
SCHEMBL26810944 0.82 MAPT (0.53) MAPTMAPK1TDP1MEN1KMT2A

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 5 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
EP-4225748-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR Vertex Pharmaceuticals Incorporated (US) 2023-08-16 EP disclosed
WO-2022076627-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-04-14 WO disclosed
WO-2022076627-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-04-14 WO 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 MAPT 4864/4885MAPK1 3810/4885TDP1 4534/4885

“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.