SCHEMBL26810132

SCHEMBL26810132

Cc1cccc(C)c1-c1cc(Oc2cc(Cl)cc(C(=O)NCC=N)c2)nc(NS(=O)(=O)c2cnn(C)c2)n1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.36
▸ FGFR1 P11362 2/20 0.36
▸ KDR P35968 2/20 0.36
▸ AURKA O14965 2/20 0.35
▸ AURKB Q96GD4 2/20 0.35
▸ CYP3A4 P08684 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ PTGDR2 Q9Y5Y4 3/20 0.33
▸ GRM5 P41594 1/20 0.33
▸ SLC6A9 P48067 1/20 0.33
▸ GPR119 Q8TDV5 3/20 0.33
▸ CCR2 P41597 2/20 0.33

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
SCHEMBL26810134 0.92 PTGDR2 (0.41) EGFRFGFR1KDRCYP3A4PTGDR2
SCHEMBL26810137 0.90 NR1H2 (0.39) EGFRFGFR1KDRAURKAAURKB
SCHEMBL26874925 0.90 FGFR1 (0.39) EGFRFGFR1KDRAURKAAURKB
SCHEMBL29566644 0.90 FGFR1 (0.39) EGFRFGFR1KDRAURKAAURKB
SCHEMBL26810139 0.90 CCR2 (0.37) EGFRFGFR1KDRCYP3A4ALDH1A1
SCHEMBL24310791 0.89 EGFR (0.38) EGFRFGFR1KDRAURKAAURKB
SCHEMBL29567535 0.89 EGFR (0.38) EGFRFGFR1KDRAURKAAURKB
SCHEMBL26810180 0.87 BRD4 (0.37) EGFRFGFR1KDRPTGDR2CCR2
SCHEMBL26810165 0.87 EGFR (0.35) EGFRFGFR1KDR
SCHEMBL26810141 0.85 GPR119 (0.38) EGFRFGFR1KDRAURKAAURKB

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 EGFR 818/4885FGFR1 2391/4885KDR 4439/4885

“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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