SCHEMBL4361653

SCHEMBL4361653

Nc1ccc(Oc2ccc3c(c2)CCC(c2ccc(Cl)cc2Cl)O3)nc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.45
POLB P06746 1/20 0.45
SLC8A1 P32418 15/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
BRCA1 P38398 1/20 0.39
HBB P68871 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL4363355 0.92 SLC8A1 (0.41) SLC8A1
SCHEMBL4368269 0.89 SLC8A1 (0.46) KDM4EPOLBSLC8A1
SCHEMBL4359956 0.86 SLC8A1 (0.49) SLC8A1
SCHEMBL4361988 0.84 PPARG (0.46) SLC8A1MEN1KMT2AALDH1A1
SCHEMBL4362096 0.84 SLC8A1 (0.42) SLC8A1
SCHEMBL4365598 0.83 SLC8A1 (0.45) SLC8A1
SCHEMBL4370223 0.83 SLC8A1 (0.47) KDM4ESLC8A1MEN1KMT2AALDH1A1
SCHEMBL4361569 0.83 SLC8A1 (0.44) KDM4EPOLBSLC8A1MEN1KMT2A
SCHEMBL4360142 0.82 MEN1 (0.47) KDM4ESLC8A1MEN1KMT2AALDH1A1
SCHEMBL4364950 0.82 SLC8A1 (0.50) KDM4EPOLBSLC8A1MEN1KMT2A

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 KDM4E 1769/4885POLB 4803/4885SLC8A1 5/4885

“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.