SCHEMBL24310041

SCHEMBL24310041

CCc1c(-c2ccccc2)nc(NS(=O)(=O)c2ccccc2)nc1-c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.58
NPSR1 Q6W5P4 2/20 0.50
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 1/20 0.49
PKM P14618 1/20 0.49
ATM Q13315 1/20 0.48
ALDH1A1 P00352 3/20 0.47
SLC40A1 Q9NP59 1/20 0.47
HSD17B10 Q99714 3/20 0.46
HSD11B1 P28845 2/20 0.46
KDM4E B2RXH2 2/20 0.45
HPGD P15428 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
LMNA P02545 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
SCHEMBL24310050 0.82 TSHR (0.59) TSHRNPSR1MAPTSMN1; SMN2GAA
SCHEMBL24310040 0.81 TSHR (0.58) TSHRNPSR1MAPTSMN1; SMN2GAA
SCHEMBL29567271 0.78 TSHR (0.50) TSHRNPSR1MAPTSMN1; SMN2GAA
SCHEMBL24309359 0.78 TSHR (0.50) TSHRNPSR1MAPTSMN1; SMN2GAA
SCHEMBL24309337 0.76 NPSR1 (0.51) TSHRNPSR1MAPTPKMATM
SCHEMBL8555072 0.76 SLC40A1 (0.45) TSHRNPSR1MAPTATMALDH1A1
SCHEMBL25352486 0.76 HSD17B10 (0.76) TSHRMAPTGAAPKMATM
SCHEMBL24309650 0.75 NPSR1 (0.50) TSHRNPSR1MAPTALDH1A1SLC40A1
SCHEMBL8475895 0.74 PTGS2 (0.54) TSHRNPSR1SMN1; SMN2PKMATM
SCHEMBL24309362 0.74 PGR (0.47) TSHRNPSR1MAPTSMN1; SMN2GAA

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 3 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
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 TSHR 1755/4885NPSR1 3974/4885MAPT 4864/4885

“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.