SCHEMBL6286329

SCHEMBL6286329

N[C@@H](COCc1ccccc1)C(=O)Nc1ccc(C(c2ccc(NC(=O)[C@@H](N)COCc3ccccc3)cc2)c2ccc(NC(=O)[C@@H](N)COCc3ccccc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 12/20 0.55
SLC1A1 P43005 1/20 0.49
BACE1 P56817 2/20 0.48
S1PR1 P21453 1/20 0.47
TACR1 P25103 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL2307636 0.90 LTA4H (0.58) LTA4HSLC1A1BACE1S1PR1TACR1
SCHEMBL27840730 0.88 LTA4H (0.56) LTA4HSLC1A1BACE1S1PR1
SCHEMBL1375677 0.88 LTA4H (0.56) LTA4HSLC1A1BACE1S1PR1NPC1
SCHEMBL27840732 0.88 LTA4H (0.56) LTA4HSLC1A1BACE1S1PR1
SCHEMBL1375675 0.88 LTA4H (0.56) LTA4HSLC1A1BACE1S1PR1NPC1
SCHEMBL1372073 0.86 S1PR1 (0.62) LTA4HS1PR1
SCHEMBL1372965 0.86 LTA4H (0.75) LTA4HNPC1RAB9ASMN1; SMN2
SCHEMBL1372071 0.86 S1PR1 (0.62) LTA4HS1PR1
SCHEMBL1372962 0.86 LTA4H (0.75) LTA4HNPC1RAB9ASMN1; SMN2
SCHEMBL6286737 0.82 BACE1 (0.63) LTA4HBACE1NPC1RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 US disclosed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US disclosed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 EP 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-20030162724-A1 Compounds exhibiting thrombopoietin-like activities MPL, THPO, TEK LTA4H 1938/4885SLC1A1 3198/4885BACE1 3304/4885

“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.