SCHEMBL4579193

SCHEMBL4579193

CCOC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 1/20 0.55
▸ GRIN3B O60391 1/20 0.55
▸ GRIN1 Q05586 1/20 0.55
▸ GRIN2A Q12879 1/20 0.55
▸ GRIN2B Q13224 1/20 0.55
▸ GRIN2C Q14957 1/20 0.55
▸ GRIN3A Q8TCU5 1/20 0.55
▸ TRPV1 Q8NER1 3/20 0.52
▸ LMNA P02545 1/20 0.51
▸ CYP3A4 P08684 3/20 0.49
▸ CYP2C9 P11712 3/20 0.49
▸ CYP19A1 P11511 2/20 0.49
▸ TSHR P16473 1/20 0.49
▸ MAPT P10636 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ CYP1A2 P05177 2/20 0.45
▸ CYP2D6 P10635 2/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ NPC1 O15118 1/20 0.45

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
SCHEMBL4578101 0.81 TRPV1 (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4578823 0.80 SMYD3 (0.54) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4577333 0.77 ALDH1A1 (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8865861 0.76 TRPV1 (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL14073718 0.75 TRPV1 (0.53) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12362001 0.74 KIF11 (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4143414 0.74 LMNA (0.53) LMNATSHRMAPTALDH1A1POLB
SCHEMBL24427973 0.73 LMNA (0.54) LMNATSHRMAPTALDH1A1KMT2A
SCHEMBL30444601 0.73 KMT2A (0.62) TRPV1CYP3A4CYP2C9CYP19A1MAPT
SCHEMBL14073845 0.73 CYP3A4 (0.82) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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 GRIN2D 2/4885GRIN3B 9/4885GRIN1 1/4885

“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.

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