SCHEMBL4361808

SCHEMBL4361808

CC(=O)NCC(=O)Nc1ccc(Oc2ccc3c(c2)C(=O)C(C)C(c2ccccc2)O3)nc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
ESR1 P03372 1/20 0.39
LTA4H P09960 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
GFER P55789 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
LMNA P02545 3/20 0.38
PABPC1 P11940 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PKM P14618 3/20 0.37
POLB P06746 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
NPC1 O15118 1/20 0.37
GAA P10253 2/20 0.36

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
SCHEMBL4360109 0.90 KMT2A (0.47) KMT2AMEN1ESR1LTA4HALDH1A1
SCHEMBL4365582 0.85 AR (0.50) MAPTHRH3NPC1SLC8A1
SCHEMBL4362298 0.84 SLC8A1 (0.53) KMT2AMEN1LTA4HALDH1A1MAPT
SCHEMBL4362275 0.81 MAOB (0.49)
SCHEMBL4360400 0.80 CSF1R (0.40) LTA4HALDH1A1MAPTGFERHRH3
SCHEMBL4358398 0.79 SLC8A1 (0.55) SLC8A1
SCHEMBL4363964 0.79 SLC8A1 (0.40) LTA4HHRH3SLC8A1
SCHEMBL4360138 0.78 ESR1 (0.45) KMT2AMEN1ESR1ALDH1A1MAPT
SCHEMBL4372639 0.78 ESR1 (0.45) KMT2AMEN1ESR1ALDH1A1MAPT
SCHEMBL4368999 0.78 SLC8A1 (0.48) HRH3SLC8A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7482340-B2 Pyridine derivatives useful for inhibiting sodium/calcium exchange system ORION CORPORATION (FI) 2009-01-27 US disclosed
US-20060241147-A1 Pyridine derivatives useful for inhibiting sodium/calcium exchange system ORION CORPORATION (FI) 2006-10-26 US disclosed
EP-1583759-A1 PYRIDINE DERIVATIVES USEFUL FOR INHIBITING SODIUM/CALCIUM EXCHANGE SYSTEM ORION CORPORATION (FI) 2005-10-12 EP disclosed
WO-2004063191-A1 PYRIDINE DERIVATIVES USEFUL FOR INHIBITING SODIUM/CALCIUM EXCHANGE SYSTEM ORION CORPORATION (FI) 2004-07-29 WO 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-20060241147-A1 Pyridine derivatives useful for inhibiting sodium/calcium exchange system SLC8B1, CACNA1A, MCU KMT2A 4533/4885MEN1 1596/4885ESR1 1827/4885

“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.