SCHEMBL6287962

SCHEMBL6287962

NCCCC[C@@](N)(C(=O)Nc1ccc(C(c2ccc(NC(=O)[C@](N)(CCCCN)C(=O)OCc3ccccc3)cc2)c2ccc(NC(=O)[C@](N)(CCCCN)C(=O)OCc3ccccc3)cc2)cc1)C(=O)OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 6/20 0.43
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
OPRK1 P41145 2/20 0.38
KDM1A O60341 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
ITGB3 P05106 4/20 0.37
ITGA2B P08514 4/20 0.37
POLB P06746 1/20 0.37
EPOR P19235 1/20 0.37

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
Hydrochloric Acid SCHEMBL6286778 0.81 LTA4H (0.52) LTA4HEPOR
SCHEMBL7210568 0.80 L3MBTL1 (0.35) LTA4HMAPT
SCHEMBL7208629 0.80 L3MBTL1 (0.35) LTA4HMAPT
Hydrochloric Acid SCHEMBL31300266 0.80 ALDH1A1 (0.44) LTA4HMAOAITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL6288018 0.79 CES1 (0.39) LTA4HTP53MAPTITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL6286281 0.79 CES1 (0.39) LTA4HTP53MAPTITGB3ITGA2B
SCHEMBL1167642 0.79 SMN1; SMN2 (0.46) LTA4HMAOAITGB3ITGA2B
SCHEMBL1167641 0.79 SMN1; SMN2 (0.46) LTA4HMAOAITGB3ITGA2B
SCHEMBL7038778 0.78 KMT2A (0.47) ITGB3
Hydrochloric Acid SCHEMBL6287860 0.78 LTA4H (0.33) LTA4HITGB3ITGA2B

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-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

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 1938/4885TP53 3089/4885MAPT 4866/4885

“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.