SCHEMBL4037018

SCHEMBL4037018

[CH2]N1CCN(C(=O)NC23CC4CC(CC(C4)C2)C3)CC1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.73
LMNA P02545 4/20 0.65
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
CNR2 P34972 1/20 0.54
HTT P42858 3/20 0.54
ALDH1A1 P00352 3/20 0.54
GAA P10253 1/20 0.53
KDM4E B2RXH2 1/20 0.53
HSD17B10 Q99714 1/20 0.53
TSHR P16473 1/20 0.52
ALOX12 P18054 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
EPHX1 P07099 1/20 0.52
HPGD P15428 1/20 0.49

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
SCHEMBL4100281 0.85 EPHX2 (0.72) EPHX2LMNAMEN1KMT2ACNR2
SCHEMBL4037025 0.84 EPHX2 (1.00) EPHX2LMNAMEN1KMT2ACNR2
SCHEMBL4099352 0.84 EPHX2 (0.70) EPHX2LMNAMEN1KMT2ACNR2
SCHEMBL12884438 0.76 EPHX2 (0.63) EPHX2LMNAMEN1KMT2ACNR2
SCHEMBL4015835 0.76 EPHX2 (0.76) EPHX2EPHX1
SCHEMBL12443646 0.76 LMNA (0.71) EPHX2LMNAMEN1KMT2ACNR2
SCHEMBL12488450 0.75 EPHX2 (0.58) EPHX2LMNAMEN1KMT2ACNR2
SCHEMBL26499136 0.73 CACNA1H (0.81) EPHX2LMNAKMT2AALDH1A1KDM4E
SCHEMBL10016587 0.72 USP2 (0.55) EPHX2LMNACNR2HTTALDH1A1
SCHEMBL4106627 0.71 EPHX2 (0.57) EPHX2LMNAMEN1KMT2ACNR2

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-20090048269-A1 CHEMICAL COMPOUNDS-821 ASTRAZENECA AB (SE) 2009-02-19 US disclosed
WO-2009022171-A1 PYRIDINYIIOXY PYRIDINES AS ALK5 INHIBITORS ASTRAZENECA AB (SE) 2009-02-19 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-20090048269-A1 CHEMICAL COMPOUNDS-821 TGFBR1, TGFBR2, SMAD3 EPHX2 3669/4885LMNA 2739/4885MEN1 218/4885

“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.