SCHEMBL22639704

SCHEMBL22639704

CC(=O)c1ccccc1OC[C@H](O)CNC1CCCC1

nearest known ligand 0.98

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.98
ABCB1 P08183 4/20 0.68
KMT2A Q03164 5/20 0.62
MEN1 O00255 4/20 0.62
ADRB2 P07550 2/20 0.57
LMNA P02545 3/20 0.57
ALDH1A1 P00352 1/20 0.57
MAPT P10636 1/20 0.57
HTT P42858 1/20 0.57
HTR1A P08908 5/20 0.56
ADRB1 P08588 1/20 0.55

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
SCHEMBL22639942 1.00 POLB (0.98) POLBABCB1KMT2AMEN1ADRB2
SCHEMBL16730155 0.81 ABCB1 (0.71) POLBABCB1KMT2AMEN1ADRB2
SCHEMBL15540233 0.81 ABCB1 (0.71) POLBABCB1KMT2AMEN1ADRB2
SCHEMBL15540629 0.81 ABCB1 (0.71) POLBABCB1KMT2AMEN1ADRB2
SCHEMBL16730153 0.81 ABCB1 (0.71) POLBABCB1KMT2AMEN1ADRB2
SCHEMBL14027346 0.79 POLB (0.63) POLBABCB1KMT2AMEN1ADRB2
SCHEMBL8891090 0.79 HTR1A (0.70) POLBABCB1KMT2AMEN1ADRB2
SCHEMBL1330304 0.78 POLB (0.62) POLBABCB1KMT2AMEN1ADRB2
SCHEMBL22639858 0.78 LMNA (0.72) POLBABCB1KMT2AMEN1LMNA
SCHEMBL22640047 0.78 LMNA (0.72) POLBABCB1KMT2AMEN1LMNA

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-10828281-B2 Non-hydrophobic compounds for use in treating metastasis and/or cartilage defect Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2020-11-10 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-10828281-B2 Non-hydrophobic compounds for use in treating metastasis and/or cartilage defect VIM, MATR3, TP53 POLB 2262/4885ABCB1 265/4885KMT2A 4613/4885

“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.