SCHEMBL4360427

SCHEMBL4360427

Clc1ccc(Oc2ccc3c(c2)OCC(c2ccccc2)C3)nc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
TTR P02766 1/20 0.41
ALOX15 P16050 3/20 0.39
ALOX12 P18054 3/20 0.39
LIPE Q05469 1/20 0.38
BRAF P15056 1/20 0.37
ALOX15B O15296 2/20 0.35

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
SCHEMBL4360147 0.89 ALOX15 (0.36) ESR1ESR2TTRALOX15ALOX12
SCHEMBL4369026 0.87 KDM4E (0.43) ESR1ESR2TTRALOX15ALOX12
SCHEMBL4368977 0.84 LIPE (0.42) LIPE
SCHEMBL4358032 0.83 HSPB1 (0.46) ESR1ESR2TTR
SCHEMBL4363967 0.80 MAPT (0.43)
SCHEMBL4362064 0.80 ADRB1 (0.41) LIPE
SCHEMBL4364062 0.79 CSF1R (0.39) LIPE
SCHEMBL4369049 0.76 KDM4E (0.44) ESR1ESR2TTRALOX15ALOX12
SCHEMBL4362356 0.76 SLC8A1 (0.51)
SCHEMBL4363593 0.76 HRH3 (0.42)

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 ESR1 1827/4885ESR2 2281/4885TTR 3349/4885

“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.