SCHEMBL4863671

SCHEMBL4863671

[CH2]CCC(n1cnc2ncccc21)n1cnc2ncccc21

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.36
LTA4H P09960 1/20 0.35
MKNK1 Q9BUB5 1/20 0.32
MKNK2 Q9HBH9 1/20 0.32
KMT2A Q03164 1/20 0.30

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
SCHEMBL4865265 0.74 MEN1 (0.37) KMT2A
SCHEMBL1106477 0.74 HIF1A (0.45) HIF1ALTA4HKMT2A
SCHEMBL20664871 0.72 HIF1A (0.44) HIF1ALTA4HMKNK1MKNK2KMT2A
SCHEMBL7196866 0.72 HIF1A (0.37) HIF1ALTA4H
SCHEMBL23760241 0.71 HIF1A (0.43) HIF1ALTA4HMKNK1MKNK2KMT2A
SCHEMBL4868652 0.71 LTA4H (0.52) LTA4HMKNK1MKNK2KMT2A
SCHEMBL21591572 0.71 HIF1A (0.39) HIF1ALTA4HMKNK1MKNK2KMT2A
SCHEMBL22606405 0.70 HIF1A (0.43) HIF1A
SCHEMBL21311454 0.70 HIF1A (0.36) HIF1ALTA4H
SCHEMBL4867446 0.69 LTA4H (0.50) LTA4HKMT2A

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-7332476-B2 Pyridyl substituted ketolide antibiotics NOVARTIS AG (CH) 2008-02-19 US disclosed
US-20050009764-A1 Pyridyl substituted ketolide antibiotics CHIRON CORPORATION (US) 2005-01-13 US disclosed
US-6756359-B2 ADMINISTERING A 14 MEMBERED MACROLIDE AND KETOLIDE ANTIBIOTICS CONTAINING C12 MODIFICATIONS TO A PATIENT SUFFERING FROM BACTERIAL INFECTIONS CHIRON CORPORATION 2004-06-29 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-20050009764-A1 Pyridyl substituted ketolide antibiotics PKLR, KHK, PGD HIF1A 4418/4885LTA4H 456/4885MKNK1 700/4885

“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.