SCHEMBL4813462

SCHEMBL4813462

O=C(c1cc2cc3oc(=O)[nH]c3cc2o1)N1CCC(OCc2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.53
GRIN2D O15399 2/20 0.53
GRIN3B O60391 2/20 0.53
GRIN1 Q05586 2/20 0.53
GRIN2A Q12879 2/20 0.53
GRIN2C Q14957 2/20 0.53
GRIN3A Q8TCU5 2/20 0.53
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ENPP2 Q13822 3/20 0.43
ATXN2 Q99700 2/20 0.43
F2 P00734 1/20 0.41
TPSAB1 Q15661 1/20 0.41
TPSD1 Q9BZJ3 1/20 0.41
TPSG1 Q9NRR2 1/20 0.41
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL4805381 0.86 GRIN1 (0.59) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4806281 0.86 GRIN2D (0.68) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7159377 0.82 GRIN2B (0.64) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7169916 0.82 GRIN2B (0.61) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4812991 0.72 GRIN2D (0.66) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4807651 0.70 GRIN2D (0.57) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4808738 0.70 KMO (0.46) ALDH1A1LMNAKMT2A
SCHEMBL7176317 0.69 GRIN2D (0.84) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7159245 0.69 GRIN2D (1.00) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL28432418 0.69 GRIN2D (0.53) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7378431-B2 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2008-05-27 US disclosed
US-7365083-B2 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2008-04-29 US disclosed
US-7361670-B2 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2008-04-22 US disclosed
US-6919355-B2 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2005-07-19 US disclosed
US-20050113359-A1 Amide derivatives as NMDA receptor antagonists HORVATH CSILLA (HU) 2005-05-26 US disclosed
US-20050113361-A1 Amide derivatives as NMDA receptor antagonists HORVATH CSILLA (HU) 2005-05-26 US disclosed
US-20050113360-A1 Amide derivatives as NMDA receptor antagonists HORVATH CSILLA (HU) 2005-05-26 US disclosed
US-20030199552-A1 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. 2003-10-23 US 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 (4 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-20050113361-A1 Amide derivatives as NMDA receptor antagonists GRIN1, GRIN3A, GRIN2B GRIN2B 3/4885GRIN2D 13/4885GRIN3B 5/4885
US-20050113360-A1 Amide derivatives as NMDA receptor antagonists GRIN1, GRIN3A, GRIN2B GRIN2B 3/4885GRIN2D 7/4885GRIN3B 5/4885
US-20050113359-A1 Amide derivatives as NMDA receptor antagonists GRIN1, GRIN3A, GRIN2B GRIN2B 3/4885GRIN2D 13/4885GRIN3B 5/4885
US-20030199552-A1 Amide derivatives as NMDA receptor antagonists GRIN1, GRIN3A, GRIN2C GRIN2B 5/4885GRIN2D 10/4885GRIN3B 8/4885

“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.