SCHEMBL5870182

SCHEMBL5870182

CC(CCC(=O)O)COCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.58
▸ SLC1A1 P43005 1/20 0.47
▸ CA1 P00915 3/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA7 P43166 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ CPA3 P15088 1/20 0.46
▸ KMT2A Q03164 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ HTT P42858 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ MAOB P27338 1/20 0.43

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
SCHEMBL6969891 0.91 FOLH1 (0.53) FOLH1TSHRHTT
SCHEMBL7179932 0.91 FOLH1 (0.52) FOLH1SLC1A1CA1CA2CA7
SCHEMBL27710469 0.86 KDM4E (0.49) FOLH1SLC1A1CA1CA2CA7
SCHEMBL31648059 0.84 CPA3 (0.63) FOLH1SLC1A1CA1CA2CA7
SCHEMBL27523288 0.84 SLC1A1 (0.50) FOLH1SLC1A1CA1CA2CA7
SCHEMBL4433522 0.83 SLC1A1 (0.49) FOLH1SLC1A1CA1CA2CA7
SCHEMBL4433529 0.83 SLC1A1 (0.49) FOLH1SLC1A1CA1CA2CA7
SCHEMBL11081443 0.83 FOLH1 (0.45) FOLH1SLC1A1CA1CA2CA7
SCHEMBL1195445 0.81 CA1 (0.50) FOLH1SLC1A1CA1CA2CA7
SCHEMBL29815484 0.81 FOLH1 (0.56) FOLH1SLC1A1CA1CA2CA7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7132449-B2 Inhibitors of cruzipain and other cysteine proteases AMURA THERAPEUTICS LIMITED (GB) 2006-11-07 — — US disclosed
US-20040127424-A1 Inhibitors of cruzipain and other cysteine proteases AMURA THERAPUTICS LIMITED (GB) 2004-07-01 — — US disclosed
EP-1358174-A2 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES Amura Therapeutics Limited (GB) 2003-11-05 — — EP disclosed
WO-2002057248-A2 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES AMURA THERAPEUTICS LIMITED (GB) 2002-07-25 — — WO 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-20040127424-A1 Inhibitors of cruzipain and other cysteine proteases CPN1, CTRL, CPA1 FOLH1 1370/4885SLC1A1 4068/4885CA1 1279/4885

“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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