SCHEMBL4359120

SCHEMBL4359120

CC(=O)NCC(=O)Nc1ccc(Oc2ccc3c(c2)CCC(c2ccccc2)C3)nc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.51
LTA4H P09960 1/20 0.41
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.39
GFER P55789 1/20 0.39
MCHR1 Q99705 1/20 0.39
FAAH O00519 2/20 0.38
OPRM1 P35372 2/20 0.38
OPRD1 P41143 2/20 0.38
OPRK1 P41145 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ADRB1 P08588 1/20 0.37
ADRB3 P13945 1/20 0.37

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
SCHEMBL4366660 0.93 HRH3 (0.47) HRH3LTA4HMAPTALDH1A1GFER
SCHEMBL4360660 0.88 HRH3 (0.47) HRH3LTA4HMAPTALDH1A1OPRM1
SCHEMBL4363593 0.85 HRH3 (0.42) HRH3LTA4HMAPTALDH1A1GFER
SCHEMBL4360562 0.83 HRH3 (0.49) HRH3LTA4HMAPTALDH1A1GFER
SCHEMBL4358398 0.83 SLC8A1 (0.55)
SCHEMBL4368999 0.83 SLC8A1 (0.48) HRH3
SCHEMBL4366500 0.80 MAPT (0.48) HRH3LTA4HMAPTALDH1A1GFER
SCHEMBL4362298 0.80 SLC8A1 (0.53) HRH3LTA4HMAPTALDH1A1GFER
SCHEMBL4365582 0.77 AR (0.50) HRH3MAPTNPC1RAB9A
SCHEMBL4358823 0.77 SLC8A1 (0.53)

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 HRH3 1703/4885LTA4H 3099/4885MAPT 2223/4885

“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.