SCHEMBL26807160

SCHEMBL26807160

Cc1ccccc1-c1cc(Oc2ccc(C(=O)O)cc2)nc(NS(=O)(=O)c2cccc(N)c2)n1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ TSHR P16473 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ SLC16A3 O15427 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ PGR P06401 1/20 0.38
▸ PIN1 Q13526 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ AKR1C3 P42330 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
SCHEMBL26807174 0.93 CA12 (0.39) CA12CA1CA2CA9TSHR
SCHEMBL24330515 0.92 ALDH1A1 (0.43) TSHRPOLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL29702903 0.92 ALDH1A1 (0.43) TSHRPOLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL24309603 0.92 POLB (0.45) CA12CA1CA2CA9TSHR
SCHEMBL26807167 0.91 MAPT (0.45) CA12CA1CA2CA9TSHR
SCHEMBL26807176 0.89 PLA2G7 (0.46) CA12CA1CA2CA9POLB
SCHEMBL24309292 0.88 TSHR (0.39) CA12CA1CA2CA9TSHR
SCHEMBL29567014 0.88 TSHR (0.39) CA12CA1CA2CA9TSHR
SCHEMBL26807170 0.85 SMN1; SMN2 (0.37) CA12CA1CA2CA9TSHR
SCHEMBL26823972 0.85 CA12 (0.41) CA12CA1CA2CA9POLB

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 CA12 4521/4885CA1 4872/4885CA2 2315/4885

“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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