SCHEMBL17726919

SCHEMBL17726919

O=C1OC(=O)c2ccc(Oc3c(F)c(F)c(F)c(F)c3F)c3cccc1c23

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 10/20 0.49
▸ POLB P06746 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.42
▸ MAPT P10636 3/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ PABPC1 P11940 1/20 0.42
▸ XBP1 P17861 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ SMARCA2 P51531 1/20 0.42
▸ NFKB2 Q00653 1/20 0.42
▸ RELA Q04206 1/20 0.42
▸ PRMT1 Q99873 1/20 0.40
▸ ALOX15 P16050 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CRHBP P24387 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34

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
SCHEMBL16291732 0.80 TYMS (0.53) TYMSPOLBKMT2AMEN1KDM4E
SCHEMBL6548245 0.76 KMT2A (0.76) TYMSPOLBKMT2AMEN1KDM4E
SCHEMBL30761754 0.76 KMT2A (0.76) TYMSPOLBKMT2AMEN1KDM4E
SCHEMBL23430836 0.75 MCL1 (0.56) TYMSPOLBKMT2AMEN1KDM4E
SCHEMBL18071160 0.75 BCL2 (0.56) TYMSPOLBKMT2AMEN1KDM4E
SCHEMBL30557400 0.75 TYMS (0.47) TYMSPOLBKMT2AMEN1KDM4E
SCHEMBL16684611 0.75 TYMS (0.47) TYMSPOLBKMT2AMEN1KDM4E
Trifluoromethanesulfonic Acid SCHEMBL17726784 0.74 KMT2A (0.41) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL17726781 0.74 KMT2A (0.41) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL4959190 0.73 TYMS (0.61) TYMSPOLBKMT2AMEN1KDM4E

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 3306/4885POLB 1811/4885KMT2A 883/4885

“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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