SCHEMBL17545696

SCHEMBL17545696

C=Cc1ccc(S(=O)(=O)N(C)S(=O)(=O)C(F)(F)C(=O)OC23CC4CC(C2)C(=O)C(C4)C3)cc1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ MMP2 P08253 1/20 0.32
▸ MMP9 P14780 1/20 0.32
▸ CYP17A1 P05093 1/20 0.31
▸ CYP19A1 P11511 1/20 0.31

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
SCHEMBL17545743 0.84 MMP2 (0.30) MMP2MMP9
SCHEMBL17545715 0.81 TSHR (0.38) TSHRNPSR1CYP17A1CYP19A1
SCHEMBL17545698 0.79 SCN9A (0.35) MMP2MMP9
SCHEMBL17540317 0.78 TSHR (0.39) TSHRNPSR1
SCHEMBL17545747 0.76 TDP1 (0.40) TSHRNPSR1MMP9
SCHEMBL17540313 0.76 TSHR (0.39) TSHRNPSR1CYP17A1CYP19A1
SCHEMBL17545699 0.73 SCN9A (0.36) —
SCHEMBL17545742 0.72 ATM (0.39) TSHR
SCHEMBL547287 0.72 TSHR (0.52) TSHRNPSR1CYP17A1CYP19A1
SCHEMBL19261603 0.72 TSHR (0.52) TSHRNPSR1CYP17A1CYP19A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160052877-A1 SALT, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-02-25 — — 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-20160052877-A1 SALT, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN RER1, AFF1, FRG1 TSHR 1306/4885NPSR1 1574/4885MMP2 3392/4885

“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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