SCHEMBL26810924

SCHEMBL26810924

Cc1nn(C)cc1-c1cc(Oc2ccccc2)nc(NS(=O)(=O)c2ccccc2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ TSHR P16473 2/20 0.48
▸ GAA P10253 2/20 0.42
▸ PKM P14618 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ GPR39 O43194 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ PIK3CD O00329 1/20 0.39
▸ PIK3CA P42336 1/20 0.39
▸ PIK3CB P42338 1/20 0.39
▸ MTOR P42345 1/20 0.39
▸ PIK3CG P48736 1/20 0.39
▸ PIK3C3 Q8NEB9 1/20 0.39

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
SCHEMBL26810782 0.83 TSHR (0.55) SMN1; SMN2TSHRGAAPKMKDM4E
SCHEMBL26810957 0.82 TSHR (0.54) SMN1; SMN2TSHRGAAPKMKDM4E
SCHEMBL24310819 0.81 MAPK1 (0.47) SMN1; SMN2TSHRGAAALDH1A1HPGD
SCHEMBL26811107 0.81 SMN1; SMN2 (0.50) SMN1; SMN2TSHRGAAPKMKDM4E
SCHEMBL26810960 0.81 TSHR (0.43) SMN1; SMN2TSHRGAAPKMKDM4E
SCHEMBL26810953 0.80 TSHR (0.48) SMN1; SMN2TSHRGAAPKMKDM4E
SCHEMBL26810909 0.80 TSHR (0.51) SMN1; SMN2TSHRGAAPKMKDM4E
SCHEMBL26811084 0.79 MAPT (0.50) SMN1; SMN2TSHRGAAPKMKDM4E
SCHEMBL26810948 0.78 TSHR (0.55) SMN1; SMN2TSHRKDM4ELMNAHPGD
SCHEMBL26806813 0.78 MAPT (0.61) SMN1; SMN2TSHRGAAPKMKDM4E

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 SMN1; SMN2 4847/4885TSHR 1755/4885GAA 904/4885

“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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