SCHEMBL17545746

SCHEMBL17545746

C=Cc1ccc(S(=O)(=O)N(C)S(=O)(=O)C(F)(F)C(=O)OCC2CCCCC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MMP3 P08254 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ CCR5 P51681 1/20 0.33
▸ PTGS2 P35354 2/20 0.33
▸ PTGES O14684 1/20 0.33
▸ TAS2R14 Q9NYV8 1/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ SCN9A Q15858 2/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ LSS P48449 1/20 0.32
▸ TRPA1 O75762 1/20 0.32

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
SCHEMBL17545689 0.80 KMT2A (0.41) ALDH1A1PTGS2KMT2A
SCHEMBL17545747 0.79 TDP1 (0.40) NPSR1ALDH1A1HTTPOLBKMT2A
SCHEMBL17545698 0.78 SCN9A (0.35) ALDH1A1KMT2AMEN1SCN9A
SCHEMBL17545742 0.75 ATM (0.39) ALDH1A1POLB
SCHEMBL17545699 0.74 SCN9A (0.36) ALDH1A1SCN9A
SCHEMBL17540308 0.73 POLB (0.34) POLBKMT2AMEN1
SCHEMBL17545701 0.72 KMT2A (0.40) ALDH1A1HTTKMT2AMEN1
SCHEMBL17545696 0.71 TSHR (0.36) NPSR1
SCHEMBL17545697 0.71 TDP1 (0.44) ALDH1A1HTTKMT2AMEN1
SCHEMBL17545745 0.68 — —

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 MMP3 3019/4885NPSR1 1574/4885ALDH1A1 2206/4885

“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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