SCHEMBL26885152

SCHEMBL26885152

CC(C)NC(=O)c1cccc2cc(O)ccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 1/20 0.50
▸ LCK P06239 1/20 0.50
▸ MET P08581 1/20 0.50
▸ KDR P35968 1/20 0.50
▸ TEK Q02763 1/20 0.50
▸ AURKB Q96GD4 1/20 0.50
▸ GFER P55789 1/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ LMNA P02545 1/20 0.47
▸ DEGS1 O15121 1/20 0.47
▸ MAOA P21397 1/20 0.46
▸ MAOB P27338 1/20 0.46
▸ PLK1 P53350 1/20 0.45
▸ ALOX5 P09917 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ MLLT1 Q03111 1/20 0.43
▸ ERN1 O75460 1/20 0.43
▸ MMP3 P08254 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ AR P10275 1/20 0.42

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
SCHEMBL13408903 0.85 AURKA (0.50) AURKALCKMETKDRTEK
SCHEMBL13392412 0.84 ALDH1A1 (0.52) AURKALCKMETKDRTEK
SCHEMBL381778 0.83 PLK1 (0.67) AURKALCKMETKDRTEK
SCHEMBL26886660 0.82 PTPN1 (0.65) AURKALCKMETKDRTEK
SCHEMBL8737627 0.82 PLK1 (0.66) ALDH1A1LMNADEGS1MAOAMAOB
SCHEMBL26886661 0.81 LCK (0.50) AURKALCKMETKDRTEK
SCHEMBL26885787 0.80 CASP6 (0.54) AURKALCKMETKDRTEK
SCHEMBL30571222 0.80 CA12 (0.54) GFERALDH1A1LMNAGAAHPGD
SCHEMBL273978 0.80 CA12 (0.54) GFERALDH1A1LMNAGAAHPGD
SCHEMBL26885154 0.79 LMNA (0.56) AURKALCKMETKDRTEK

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-20230381159-A1 SMALL MOLECULE INHIBITORS OF CORONAVIRUS ATTACHMENT AND ENTRY, METHODS AND USES THEREOF UNIVERSITY OF MIAMI 2023-11-30 — — 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-20230381159-A1 SMALL MOLECULE INHIBITORS OF CORONAVIRUS ATTACHMENT AND ENTRY, METHODS AND USES THEREOF ACE2, ACE, SARS1 AURKA 1451/4885LCK 863/4885MET 1167/4885

“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.

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