SCHEMBL3201173

SCHEMBL3201173

COC(=O)CC1C(=O)Nc2ccccc21.O=C(O)CC1C(=O)Nc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.65
HTT P42858 1/20 0.52
HSD17B10 Q99714 1/20 0.52
IDO1 P14902 10/20 0.52
TDO2 P48775 4/20 0.52
GAA P10253 2/20 0.46
MAPT P10636 3/20 0.44
KDM4E B2RXH2 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL8998987 0.94 EGFR (0.72) EGFRHTTHSD17B10IDO1TDO2
SCHEMBL1302976 0.89 EGFR (0.69) EGFRHSD17B10IDO1TDO2GAA
SCHEMBL29437202 0.89 EGFR (0.69) EGFRHSD17B10IDO1TDO2GAA
Oxindole SCHEMBL3201159 0.83 EGFR (0.57) EGFRHTTHSD17B10IDO1TDO2
SCHEMBL320134 0.81 IDO1 (0.57) EGFRHTTHSD17B10IDO1TDO2
SCHEMBL28573090 0.81 MAPT (0.59) EGFRHSD17B10IDO1TDO2GAA
SCHEMBL5279457 0.80 IDO1 (0.59) EGFRIDO1TDO2GAAMAPT
SCHEMBL1388345 0.79 EGFR (1.00) EGFRHTTHSD17B10IDO1TDO2
SCHEMBL8999189 0.78 IDO1 (0.55) EGFRIDO1TDO2GAAMAPT
SCHEMBL10789721 0.78 IDO1 (0.66) EGFRIDO1TDO2L3MBTL1

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
CN-119619358-A Metabolic marker for detecting novel coronavirus combined with Epstein-Barr virus infection and application thereof 湖北医药学院附属襄阳市第一人民医院 2025-03-14 CN disclosed
US-20100041900-A1 Isolation of lactam compound from adlay bran and its use on anti-proliferative cancer cells KUANG TA FOODS CO., LTD (TW) 2010-02-18 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-20100041900-A1 Isolation of lactam compound from adlay bran and its use on anti-proliferative cancer cells MLX, BROX, TOP1 EGFR 544/4885HTT 4839/4885HSD17B10 1549/4885

“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.