SCHEMBL17726839

SCHEMBL17726839

O=C1OC(=O)c2ccc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c3cccc1c23

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 6/20 0.47
▸ TDP1 Q9NUW8 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ELANE P08246 1/20 0.32
▸ RGS12 O14924 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ PARP1 P09874 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ APEX1 P27695 1/20 0.30
▸ CASP1 P29466 1/20 0.30
▸ BRCA1 P38398 1/20 0.30
▸ MTOR P42345 1/20 0.30
▸ RECQL P46063 1/20 0.30

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
SCHEMBL17726773 0.98 TYMS (0.49) TYMSTDP1MEN1POLBKMT2A
Trifluoromethanesulfonic Acid SCHEMBL17726926 0.77 MEN1 (0.42) TDP1MEN1POLBKMT2AALOX15
Trifluoromethanesulfonic Acid SCHEMBL17726897 0.75 MEN1 (0.43) TDP1MEN1POLBKMT2AALOX15
SCHEMBL19033227 0.74 TYMS (0.56) TYMSTDP1MEN1POLBKMT2A
SCHEMBL17726813 0.72 MEN1 (0.38) TDP1MEN1POLBKMT2ARGS12
SCHEMBL10267341 0.71 TYMS (0.70) TYMSTDP1MEN1POLBKMT2A
SCHEMBL17726884 0.71 MEN1 (0.39) TDP1MEN1POLBKMT2ARGS12
SCHEMBL4959190 0.69 TYMS (0.61) TYMSTDP1MEN1POLBKMT2A
SCHEMBL31094972 0.69 TYMS (0.61) TYMSTDP1MEN1POLBKMT2A
SCHEMBL4960377 0.69 TYMS (0.61) TYMSTDP1MEN1POLBKMT2A

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-20160368879-A1 PHOTOACID GENERATOR, AND RESIN COMPOSITION FOR PHOTOLITHOGRAPHY SAN-APRO LTD. (JP) 2016-12-22 — — US disclosed
EP-3018182-A1 PHOTOACID GENERATOR, AND RESIN COMPOSITION FOR PHOTOLITHOGRAPHY San-Apro Limited (JP) 2016-05-11 — — EP 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-20160368879-A1 PHOTOACID GENERATOR, AND RESIN COMPOSITION FOR PHOTOLITHOGRAPHY ARL1, GARS1, SPTBN1 TYMS 3306/4885TDP1 4488/4885MEN1 2234/4885

“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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