SCHEMBL19147108

SCHEMBL19147108

C=C/C=C(\C=C/C)CC(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
TSHR P16473 3/20 0.34
POLB P06746 1/20 0.33
POLA1 P09884 1/20 0.33
HSD17B10 Q99714 1/20 0.32
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
HCAR2 Q8TDS4 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
SCHEMBL19018668 0.82 LMNA (0.33) LMNATSHRHCAR2
SCHEMBL19187314 0.81
SCHEMBL27547653 0.80 ALOX15 (0.33) HSD17B10
SCHEMBL13176855 0.80 ALOX15 (0.33) HSD17B10
SCHEMBL13740265 0.78 TSHR (0.30) TSHR
SCHEMBL13631097 0.74
SCHEMBL14367612 0.73 MGAM (0.33) ALDH1A1LMNAMGAMGAASI
SCHEMBL22856027 0.72
SCHEMBL18533613 0.72 PTPN1 (0.39) ALDH1A1LMNAHSD17B10
SCHEMBL18532646 0.72 GAA (0.37) ALDH1A1MGAMGAASIMGAM2

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
WO-2017127409-A1 2-OXINDOLE COMPOUNDS CHEMOCENTRYX, INC. (US) 2017-07-27 WO disclosed
US-20170204087-A1 2-OXINDOLE COMPOUNDS CHEMOCENTRYX, INC. 2017-07-20 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-20170204087-A1 2-OXINDOLE COMPOUNDS CCR9, CCR1, CCRL2 ALDH1A1 1553/4885LMNA 4300/4885MGAM 4565/4885

“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.