SCHEMBL6421886

SCHEMBL6421886

CC(C)(C)N(NC(=O)c1ccc(O)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.58
CYP3A4 P08684 1/20 0.54
CYP2C9 P11712 1/20 0.54
HPGD P15428 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL4257189 0.86 POLB (0.77) POLBCYP3A4CYP2C9
SCHEMBL9714073 0.84 POLB (0.85) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL9714077 0.84 POLB (0.85) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL6421565 0.76 PTPN1 (0.58) POLBHPGDSMN1; SMN2
SCHEMBL6421890 0.76 POLB (0.58) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL9180922 0.76 CYP3A4 (0.47) POLBCYP3A4CYP2C9
SCHEMBL10720343 0.75 ABCB1 (0.74) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
Rh-5849 SCHEMBL1538531 0.74 POLB (1.00) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL8174887 0.74 POLB (0.75) POLBCYP3A4CYP2C9
SCHEMBL6800377 0.74 GFER (0.54) POLBCYP3A4HPGDSMN1; SMN2

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-20050043388-A1 Oxindole hydrazide modulators of protein tyrosine phosphatases (ptps) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. 2005-02-24 US claimed

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-20050043388-A1 Oxindole hydrazide modulators of protein tyrosine phosphatases (ptps) PTPRO, PTPRE, PTPRZ1 POLB 4789/4885CYP3A4 1654/4885CYP2C9 1510/4885

“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.