SCHEMBL6367264

SCHEMBL6367264

O=C(O)N1CCC2(CCN(Cc3ccc(Oc4nc5ccccc5s4)cc3)CC2)CC1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 16/20 0.68
KCNH2 Q12809 9/20 0.64
CYP3A4 P08684 3/20 0.52
CYP2D6 P10635 2/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2C19 P33261 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
USP2 O75604 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPK1 P28482 1/20 0.52
GHSR Q92847 1/20 0.50
CYP2C9 P11712 1/20 0.50

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
SCHEMBL6362980 0.91 LTA4H (0.74) LTA4HKCNH2CYP3A4CYP2D6CYP1A2
SCHEMBL4694644 0.88 LTA4H (0.60) LTA4HKCNH2CYP3A4CYP2D6CYP1A2
SCHEMBL4692397 0.83 LTA4H (0.75) LTA4HKCNH2
SCHEMBL4693430 0.83 LTA4H (0.74) LTA4HKCNH2CYP3A4CYP2D6CYP1A2
SCHEMBL4709368 0.82 LTA4H (0.75) LTA4HKCNH2
SCHEMBL3628094 0.82 LTA4H (0.67) LTA4HKCNH2CYP3A4CYP2D6CYP1A2
SCHEMBL4692427 0.82 LTA4H (0.71) LTA4HKCNH2CYP3A4CYP2D6CYP1A2
SCHEMBL4709093 0.82 LTA4H (0.74) LTA4HKCNH2CYP3A4CYP2D6CYP1A2
SCHEMBL4690998 0.81 LTA4H (0.67) LTA4HKCNH2CYP3A4CYP2D6CYP1A2
SCHEMBL1896239 0.81 LTA4H (1.00) LTA4HKCNH2

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-3793602-A1 TREATMENT OF AGING-ASSOCIATED DISEASE WITH MODULATORS OF LEUKOTRIENE A4 HYDROLASE Alkahest, Inc. (US) 2021-03-24 EP disclosed
US-20050043379-A1 LTA4H Modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2005-02-24 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-20050043379-A1 LTA4H Modulators LTA4H, LTB4R, LTB4R2 LTA4H 1/4885KCNH2 3429/4885CYP3A4 267/4885

“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.