SCHEMBL4575808

SCHEMBL4575808

COc1cc(-c2ccccc2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.62
CA2 P00918 2/20 0.62
BACE1 P56817 4/20 0.55
PDE4B Q07343 4/20 0.46
ABL1 P00519 2/20 0.45
ABCB1 P08183 2/20 0.45
BCR P11274 2/20 0.45
PDE4A P27815 3/20 0.43
PDE4C Q08493 3/20 0.43
PDE4D Q08499 3/20 0.43
METAP2 P50579 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL7647539 0.88 CA1 (0.59) CA1CA2BACE1ABL1ABCB1
SCHEMBL5989278 0.84 BACE1 (0.73) BACE1PDE4BABL1ABCB1BCR
SCHEMBL240515 0.84 CA2 (0.80) CA1CA2MEN1KMT2AALDH1A1
SCHEMBL29602570 0.84 CA2 (0.80) CA1CA2MEN1KMT2AALDH1A1
Phenol SCHEMBL9404586 0.81 CA2 (0.75) CA1CA2BACE1PDE4BABL1
SCHEMBL510694 0.81 CA2 (0.59) CA1CA2BACE1PDE4BMEN1
SCHEMBL21753677 0.80 CA2 (0.57) CA1CA2BACE1PDE4BMEN1
SCHEMBL29933298 0.79 CA2 (0.61) CA1CA2BACE1ABL1ABCB1
SCHEMBL7645330 0.79 CA2 (0.61) CA1CA2BACE1ABL1ABCB1
SCHEMBL39130 0.78 CA2 (1.00) CA1CA2MEN1KMT2AALDH1A1

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-7371879-B2 Bivalent monomeric phenoxy tin compounds E.I. DU PONT DE NEMOURS AND COMPANY (US) 2008-05-13 US claimed
US-20070244325-A1 Polymerization processes using bivalent monomeric phenoxy tin catalysts E. I. DU PONT DE NEMOURS AND COMPANY 2007-10-18 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-20070244325-A1 Polymerization processes using bivalent monomeric phenoxy tin catalysts PCNA, BMI1, TET2 CA1 4399/4885CA2 3703/4885BACE1 4459/4885

“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.