SCHEMBL26885787

SCHEMBL26885787

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 2/20 0.54
▸ AURKA O14965 1/20 0.47
▸ LCK P06239 1/20 0.47
▸ MET P08581 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ TEK Q02763 1/20 0.47
▸ AURKB Q96GD4 1/20 0.47
▸ LMNA P02545 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ RHOA P61586 1/20 0.44
▸ SCN9A Q15858 1/20 0.42
▸ MAOA P21397 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ THRB P10828 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ PLK1 P53350 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ PABPC1 P11940 1/20 0.40
▸ APOBEC3A P31941 1/20 0.40

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
SCHEMBL26885768 0.89 MTNR1A (0.46) CASP6AURKALCKMETKDR
SCHEMBL26885809 0.82 APEX1 (0.46) CASP6LMNAALDH1A1MAOAMAOB
SCHEMBL26885152 0.80 AURKA (0.50) AURKALCKMETKDRTEK
SCHEMBL13408903 0.80 AURKA (0.50) AURKALCKMETKDRTEK
SCHEMBL26886013 0.80 PRMT1 (0.43) CASP6LMNAALDH1A1HPGDERN1
SCHEMBL13392412 0.79 ALDH1A1 (0.52) AURKALCKMETKDRTEK
SCHEMBL10385032 0.78 PTPN1 (0.60) CASP6ALDH1A1RHOAHPGDCYP2C9
SCHEMBL26886660 0.78 PTPN1 (0.65) AURKALCKMETKDRTEK
SCHEMBL8737627 0.78 PLK1 (0.66) LMNAALDH1A1MAOAMAOBTHRB
SCHEMBL26885154 0.77 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 2 patents. 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
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 CASP6 2657/4885AURKA 1451/4885LCK 863/4885

“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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