SCHEMBL21297714

SCHEMBL21297714

COCC(=O)c1cc(C(C)(C)C)c(COC)c(C(C)(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.37
PTGS1 P23219 6/20 0.37
ALOX5 P09917 5/20 0.37
HCAR2 Q8TDS4 1/20 0.36
LMNA P02545 1/20 0.35
RECQL P46063 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
TNFRSF1A P19438 2/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
F2R P25116 1/20 0.32
CYP3A4 P08684 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
SCHEMBL19753674 0.84 PTGS1 (0.35) PTGS2PTGS1ALOX5LMNARECQL
SCHEMBL21297713 0.83 HCAR2 (0.41) PTGS2HCAR2LMNARECQLMEN1
SCHEMBL20913297 0.76 ALDH1A1 (0.43) HCAR2LMNARECQLMEN1KMT2A
SCHEMBL2772375 0.75 ACHE (0.42) LMNARECQLMEN1KMT2ACYP3A4
SCHEMBL7248268 0.70 GABBR2 (0.36) MEN1KMT2ACYP3A4
SCHEMBL21297731 0.69 SERPINE1 (0.37)
SCHEMBL8427360 0.69 TPMT (0.48) MEN1KMT2A
SCHEMBL5789171 0.68 ALDH1A1 (0.62) LMNARECQLMEN1KMT2A
SCHEMBL8427325 0.67 TPMT (0.46) LMNAMEN1KMT2A
SCHEMBL10497616 0.67 KDM4E (0.49) LMNAMEN1KMT2A

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-10394122-B2 Resist composition, method for forming resist pattern, compound, and acid generator TOYKO OHKA KOGYO CO., LTD. (JP) 2019-08-27 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-10394122-B2 Resist composition, method for forming resist pattern, compound, and acid generator RB1, FXR1, CCNA1 PTGS2 4199/4885PTGS1 3384/4885ALOX5 1440/4885

“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.