SCHEMBL17975263

SCHEMBL17975263

C/C=C1/CCC/C(=C\C(C)(C)C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.36
F3 P13726 2/20 0.34
EGFR P00533 2/20 0.33
NFE2L2 Q16236 1/20 0.33
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
GAA P10253 2/20 0.33
USP2 O75604 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
TLR9 Q9NR96 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NOD2 Q9HC29 1/20 0.33
HSD11B1 P28845 2/20 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
SCHEMBL17975258 1.00 CYP1A2 (0.36) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL17975259 1.00 CYP1A2 (0.36) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL17975264 1.00 CYP1A2 (0.36) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL12948751 0.91 CYP1A2 (0.34) CYP1A2CYP2C9
SCHEMBL17975265 0.91 CYP1A2 (0.34) CYP1A2CYP2C9
SCHEMBL17975257 0.91 CYP1A2 (0.34) CYP1A2CYP2C9
SCHEMBL17975284 0.91 CYP1A2 (0.34) CYP1A2CYP2C9
SCHEMBL17975266 0.91 CYP1A2 (0.34) CYP1A2CYP2C9
SCHEMBL17975262 0.91 CYP1A2 (0.41) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL17975261 0.91 CYP1A2 (0.41) CYP1A2F3EGFRNFE2L2MAPT

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-20160374997-A1 ANTIBIOTIC COMPOUNDS THAT INHIBIT BACTERIAL PROTEIN SYNTHESIS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2016-12-29 US disclosed
US-20160220510-A1 ANTIBIOTIC COMPOUNDS THAT INHIBIT BACTERIAL PROTEIN SYNTHESIS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2016-08-04 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 (2 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-20160374997-A1 ANTIBIOTIC COMPOUNDS THAT INHIBIT BACTERIAL PROTEIN SYNTHESIS AARS1, EPRS1, EEF1G CYP1A2 3382/4885F3 780/4885EGFR 373/4885
US-20160220510-A1 ANTIBIOTIC COMPOUNDS THAT INHIBIT BACTERIAL PROTEIN SYNTHESIS AARS1, EPRS1, EEF1G CYP1A2 3382/4885F3 780/4885EGFR 373/4885

“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.