SCHEMBL24310819

SCHEMBL24310819

Cc1nn(C)cc1S(=O)(=O)Nc1nc(Oc2ccccc2)cc(-c2ccccc2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ KMT2A Q03164 4/20 0.46
▸ MEN1 O00255 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ POLB P06746 1/20 0.43
▸ MAPT P10636 4/20 0.41
▸ CYP1A2 P05177 3/20 0.40
▸ CYP2C9 P11712 3/20 0.40
▸ CYP2C19 P33261 3/20 0.40
▸ ATM Q13315 2/20 0.40
▸ GPR39 O43194 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TSHR P16473 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ BRD4 O60885 1/20 0.37

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
SCHEMBL26812907 0.82 TDP1 (0.49) MAPK1TDP1ALDH1A1SMN1; SMN2MAPT
SCHEMBL29566921 0.81 MAPK1 (0.44) MAPK1TDP1KMT2AMEN1ALDH1A1
SCHEMBL26810924 0.81 SMN1; SMN2 (0.48) KMT2AALDH1A1SMN1; SMN2MAPTCYP1A2
SCHEMBL24310212 0.81 MAPK1 (0.44) MAPK1TDP1KMT2AMEN1ALDH1A1
SCHEMBL24310808 0.81 MAPK1 (0.46) MAPK1TDP1KMT2AMEN1ALDH1A1
SCHEMBL26813009 0.80 MAPK1 (0.43) MAPK1TDP1KMT2AMEN1ALDH1A1
SCHEMBL24309685 0.80 MAPT (0.47) MAPK1TDP1KMT2AMEN1ALDH1A1
SCHEMBL26812931 0.80 MAPK1 (0.45) MAPK1TDP1KMT2AMEN1ALDH1A1
SCHEMBL26812913 0.78 ACLY (0.48) MAPK1TDP1KMT2AMEN1ALDH1A1
SCHEMBL26806813 0.78 MAPT (0.61) MAPK1TDP1KMT2AMEN1ALDH1A1

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 MAPK1 3810/4885TDP1 4534/4885KMT2A 4613/4885

“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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