SCHEMBL4577307

SCHEMBL4577307

O=C(CN1CCC(Cc2ccccc2)CC1)Nc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.67
LMNA P02545 2/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
ALDH1A1 P00352 3/20 0.65
ACHE P22303 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.56
POLB P06746 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
GRIN1 Q05586 1/20 0.56
GRIN2B Q13224 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA9 Q16790 1/20 0.56
FAAH O00519 2/20 0.56
MEN1 O00255 1/20 0.56
HTT P42858 1/20 0.56
KMT2A Q03164 1/20 0.56

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
SCHEMBL28599359 0.90 KDM4E (0.71) KDM4ELMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL4414755 0.88 KDM4E (0.69) KDM4ELMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL4578765 0.87 MEN1 (0.70) KDM4ELMNAL3MBTL1ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL4577724 0.86 KDM4E (0.67) KDM4ELMNAL3MBTL1ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL4578881 0.85 KDM4E (0.66) KDM4ELMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL4576852 0.84 SMN1; SMN2 (0.72) KDM4ELMNAL3MBTL1ALDH1A1ACHE
SCHEMBL4578306 0.84 KDM4E (0.64) KDM4ELMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL4576715 0.83 LMNA (0.72) KDM4ELMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL4577386 0.83 LMNA (0.66) KDM4ELMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL31212418 0.83 CA1 (0.80) KDM4ELMNAL3MBTL1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7435744-B2 Piperidine derivatives as NMDA receptor antagonists GEDEON RICHTER VEGYESZETI GYAR RT (HU) 2008-10-14 US disclosed
EP-1409477-B1 PIPERIDINE DERIVATIVES AS NMDA RECEPTOR ANTAGONISTS RICHTER GEDEON NYRT (HU) 2008-09-17 EP disclosed
US-20040157886-A1 Piperdine derivatives as NMDA receptor antagonists UCB Biopharma SRL (BE) 2004-08-12 US disclosed
EP-1409477-A1 PIPERIDINE DERIVATIVES AS NMDA RECEPTOR ANTAGONISTS RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 2004-04-21 EP disclosed
WO-2003010159-A1 PIPERIDINE DERIVATIVES AS NMDA RECEPTOR ANTAGONISTS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2003-02-06 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-20040157886-A1 Piperdine derivatives as NMDA receptor antagonists GRIN1, GRIN2D, GRIN2C KDM4E 1161/4885LMNA 4778/4885L3MBTL1 4145/4885

“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.