SCHEMBL19862654

SCHEMBL19862654

C=C(C)C(=O)NCCOC(=O)C(F)(F)S(=O)(=O)OC(C)C(=O)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.34
USP2 O75604 3/20 0.34
CHRM3 P20309 2/20 0.34
CYP1A2 P05177 2/20 0.34
NR1I2 O75469 1/20 0.34
ADRB1 P08588 1/20 0.34
HTR1A P08908 1/20 0.34
ADRA2A P08913 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
SLC6A2 P23975 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
SLC6A4 P31645 1/20 0.34
ADRA1A P35348 1/20 0.34
HRH1 P35367 1/20 0.34
OPRM1 P35372 1/20 0.34
DRD3 P35462 1/20 0.34
HTR2B P41595 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
SCHEMBL19862660 0.86 KMT2A (0.33) USP2SMN1; SMN2MAPTHPGDALDH1A1
SCHEMBL19862655 0.84 CYP3A4 (0.34) CYP3A4USP2CHRM3CYP1A2NR1I2
SCHEMBL19862674 0.77 CYP3A4 (0.34) CYP3A4USP2CHRM3CYP1A2NR1I2
SCHEMBL19862667 0.74 POLB (0.33) CYP3A4USP2CHRM3CYP1A2NR1I2
SCHEMBL10712444 0.72 MAPT (0.42) CYP3A4USP2ADRA2AADRA2BHTR2A
SCHEMBL19865204 0.71 MAPT (0.38) CYP3A4ADRA2AADRA2BHTR2AHRH1
SCHEMBL19862668 0.69 SMN1; SMN2 (0.37) CYP3A4USP2CYP1A2SMN1; SMN2NPSR1
SCHEMBL9247552 0.67 MDM2 (0.46) CYP3A4ADRA2AADRA2BHTR2AHRH1
SCHEMBL12705092 0.67 POLB (0.37) NPSR1MAPTALDH1A1MAPK1
SCHEMBL775595 0.67 POLB (0.37) NPSR1MAPTALDH1A1MAPK1

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-9951164-B2 Non-ionic aryl ketone based polymeric photo-acid generators INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2018-04-24 US disclosed
US-20180044459-A1 NON-IONIC ARYL KETONE BASED POLYMERIC PHOTO-ACID GENERATORS CENTRAL GLASS CO., LTD. (JP) 2018-02-15 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-20180044459-A1 NON-IONIC ARYL KETONE BASED POLYMERIC PHOTO-ACID GENERATORS PPARG, PPARA, PPARD CYP3A4 763/4885USP2 1844/4885CHRM3 4455/4885

“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.