SCHEMBL5596963

SCHEMBL5596963

[CH2]CCOC(=O)NC1CCCC1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 13/20 0.63
SMN1; SMN2 Q16637 3/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP3A4 P08684 1/20 0.43
EPHX2 P34913 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL5597158 0.98 EPHX1 (0.66) EPHX1SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL5596388 0.96 EPHX1 (0.58) EPHX1SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL5597219 0.92 EPHX1 (0.53) EPHX1SMN1; SMN2ALDH1A1EPHX2
SCHEMBL5597218 0.89 EPHX1 (0.64) EPHX1SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL5597213 0.87 EPHX1 (0.67) EPHX1SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL5596623 0.85 EPHX1 (0.59) EPHX1SMN1; SMN2ALDH1A1EPHX2
SCHEMBL5596837 0.84 EPHX1 (0.57) EPHX1SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL482520 0.82 EPHX1 (0.60) EPHX1SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL5596644 0.81 EPHX1 (0.54) EPHX1SMN1; SMN2ALDH1A1
SCHEMBL8653001 0.81 EPHX1 (0.63) EPHX1SMN1; SMN2RAB9ANPC1ALDH1A1

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
EP-1829876-A1 NITROGENEOUS TRICYCLIC COMPOUND Asahi Kasei Pharma Corporation (JP) 2007-09-05 EP disclosed
US-20060247266-A1 Nitrogen-containing tricyclic compounds ASAHI KASEI PHARMA CORPORATION (JP) 2006-11-02 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-20060247266-A1 Nitrogen-containing tricyclic compounds MYO1B, CHRM1, MYL12A EPHX1 4424/4885SMN1; SMN2 2149/4885RAB9A 1808/4885

“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.