SCHEMBL4358002

SCHEMBL4358002

O=C(CCl)Nc1ccc(Oc2ccc3c(c2)OC(c2ccccc2)CC3=O)nc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.50
CYP19A1 P11511 5/20 0.50
MAOA P21397 1/20 0.45
PSMB5 P28074 1/20 0.45
CYP3A4 P08684 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL4366138 0.93 AR (0.50) MAOBCYP19A1CYP3A4KDM4EMEN1
SCHEMBL4362275 0.88 MAOB (0.49) MAOBCYP19A1CYP3A4
SCHEMBL4372314 0.85 MAPT (0.44) CYP3A4KDM4EMEN1MAPTKMT2A
SCHEMBL4360052 0.84 SLC8A1 (0.49)
SCHEMBL4361884 0.84 SLC8A1 (0.55)
SCHEMBL4365582 0.82 AR (0.50) MAOBCYP19A1MAPT
SCHEMBL4362574 0.82 MAPT (0.43) CYP3A4KDM4EMEN1MAPTKMT2A
SCHEMBL4365832 0.81 MAOB (0.60) MAOBCYP19A1MAOAPSMB5CYP3A4
SCHEMBL4365391 0.80 SLC8A1 (0.55) CYP3A4KDM4EMEN1MAPTKMT2A
SCHEMBL4362861 0.79 MAOB (0.60) MAOBCYP19A1MAOAPSMB5CYP3A4

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 MAOB 1212/4885CYP19A1 2119/4885MAOA 1501/4885

“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.