SCHEMBL17018477

SCHEMBL17018477

COC(=O)c1cccc([C@@](C)(N)CO)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.54
CYP4F2 P78329 2/20 0.53
CYP4A11 Q02928 2/20 0.53
LOX P28300 1/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
SLC7A5 Q01650 1/20 0.47
ALDH1A1 P00352 2/20 0.47
TSHR P16473 1/20 0.46
P4HB P07237 1/20 0.45
RAB9A P51151 2/20 0.44
POLB P06746 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.43
ACHE P22303 1/20 0.43
EGFR P00533 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
PKM P14618 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
SCHEMBL12065517 0.85 LOXL2 (0.54) LOXL2CYP4F2CYP4A11LOXCA12
SCHEMBL1787501 0.82 ACHE (0.59) LOXL2CYP4F2CYP4A11CA12CA1
SCHEMBL2892597 0.82 TSHR (0.53) LOXL2CYP4F2CYP4A11CA12CA1
SCHEMBL5377475 0.81 CYP1A2 (0.54) LOXL2CYP4F2CYP4A11LOXCA12
SCHEMBL4443803 0.81 LOXL2 (0.58) LOXL2CYP4F2CYP4A11LOXCA12
SCHEMBL17021938 0.80 MAPT (0.59) LOXL2CYP4F2CYP4A11CA12CA1
SCHEMBL548002 0.80 TSHR (0.52) LOXL2CYP4F2CYP4A11CA12CA1
SCHEMBL20717662 0.80 P4HB (0.53) LOXL2CYP4F2CYP4A11CA12CA1
SCHEMBL1787753 0.79 LOXL2 (0.51) LOXL2CYP4F2CYP4A11CA12CA1
SCHEMBL3933098 0.79 TAS1R3 (0.54) LOXL2CYP4F2CYP4A11CA12CA1

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-9278968-B2 Imidazopyridine compounds ASTELLAS PHARMA INC. (JP) 2016-03-08 US disclosed
US-9278968-B2 Imidazopyridine compounds ASTELLAS PHARMA INC. (JP) 2016-03-08 US disclosed
US-20150232464-A1 IMIDAZOPYRIDINE COMPOUNDS ASTELLAS PHARMA INC. (JP) 2015-08-20 US disclosed
US-20150232464-A1 IMIDAZOPYRIDINE COMPOUNDS ASTELLAS PHARMA INC. (JP) 2015-08-20 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-20150232464-A1 IMIDAZOPYRIDINE COMPOUNDS PRKG1, PDE3B, PDE3A LOXL2 4493/4885CYP4F2 4668/4885CYP4A11 3007/4885

“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.