SCHEMBL26812848

SCHEMBL26812848

COc1ccc(S(=O)(=O)Nc2nc(Oc3ccccc3)cc(-c3ccccc3)n2)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.50
▸ TSHR P16473 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ ADAMTS4 O75173 1/20 0.47
▸ MMP1 P03956 1/20 0.47
▸ MMP2 P08253 1/20 0.47
▸ MMP13 P45452 1/20 0.47
▸ MMP14 P50281 1/20 0.47
▸ ADAMTS5 Q9UNA0 1/20 0.47
▸ MAPK1 P28482 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ BCL2L1 Q07817 1/20 0.44
▸ MCL1 Q07820 1/20 0.44
▸ GPR39 O43194 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ PTGES2 Q9H7Z7 1/20 0.42

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
SCHEMBL26810931 0.90 TSHR (0.56) MAPTTSHRSMN1; SMN2TDP1GPR39
SCHEMBL26813034 0.87 MAPT (0.57) MAPTTSHRSMN1; SMN2MAPK1TDP1
SCHEMBL24310594 0.86 MAPT (0.57) MAPTTSHRSMN1; SMN2ADAMTS4MMP1
SCHEMBL26812827 0.86 MAPT (0.51) MAPTTSHRSMN1; SMN2ADAMTS4MMP1
SCHEMBL26812852 0.85 MAPT (0.50) MAPTSMN1; SMN2ADAMTS4MMP1MMP2
SCHEMBL26806813 0.84 MAPT (0.61) MAPTTSHRSMN1; SMN2MAPK1TDP1
SCHEMBL24310185 0.84 PGR (0.58) MAPTTSHRSMN1; SMN2MAPK1TDP1
SCHEMBL26812683 0.83 MAPT (0.48) MAPTTSHRSMN1; SMN2ADAMTS4MMP1
SCHEMBL26813023 0.83 MAPT (0.58) MAPTTSHRSMN1; SMN2MAPK1TDP1
SCHEMBL26806972 0.83 TSHR (0.57) MAPTTSHRSMN1; SMN2MAPK1TDP1

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 MAPT 4864/4885TSHR 1755/4885SMN1; SMN2 4847/4885

“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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