SCHEMBL7253294

SCHEMBL7253294

OCC#CCN1CCC(Cc2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 2/20 0.65
GRIN2B Q13224 1/20 0.65
LMNA P02545 1/20 0.62
HTT P42858 1/20 0.62
CCR3 P51677 3/20 0.59
PRMT3 O60678 1/20 0.55
CARM1 Q86X55 1/20 0.55
PRMT6 Q96LA8 1/20 0.55
PRMT1 Q99873 1/20 0.55
PRMT8 Q9NR22 1/20 0.55
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
SIGMAR1 Q99720 2/20 0.52
ALDH1A1 P00352 1/20 0.52

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
SCHEMBL7251334 0.83 GRIN1 (0.63) GRIN1GRIN2BLMNAHTTCCR3
SCHEMBL7402973 0.82 GRIN2B (0.77) GRIN1GRIN2BLMNAHTT
SCHEMBL14067111 0.80 CCR3 (0.71) CCR3PRMT3CARM1PRMT6PRMT1
SCHEMBL10772998 0.80 CCR3 (0.65) GRIN1GRIN2BLMNAHTTCCR3
SCHEMBL18026661 0.80 MAOA (0.72) GRIN1GRIN2BLMNAHTTCCR3
SCHEMBL1307198 0.80 CCR3 (0.65) GRIN1GRIN2BLMNAHTTCCR3
SCHEMBL7403298 0.79 GRIN1 (0.58) GRIN1GRIN2BLMNAHTTCCR3
SCHEMBL7249730 0.78 LMNA (0.61) GRIN1GRIN2BLMNAHTTCCR3
SCHEMBL7248849 0.78 CCR3 (0.73) GRIN2BCCR3PRMT3CARM1PRMT6
SCHEMBL7399063 0.77 GRIN1 (0.56) GRIN1GRIN2BLMNAHTTCCR3

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-20030144319-A1 Subtype-selective NMDA receptor ligands and the use thereof BIGGE CHRISTOPHER F (US) 2003-07-31 US disclosed
US-6534522-B2 E.g.,N-((4-amino-3-nitrophenoxy)ethyl)-1,2,3,4-tetrahydro -isoquinoline; stroke; antiischemic agents; CNS trauma, hyperglycemic agents; surgery; neurodegenerative diseases including Alzheimer's disease, amyotrophic lateral sclerosis WARNER-LAMBERT COMPANY 2003-03-18 US disclosed
US-20010051633-A1 Subtype-selective NMDA receptor ligands and the use thereof BIGGE CHRISTOPHER F (US) 2001-12-13 US disclosed
US-6218404-B1 THERAPY AND PROPHYLAXIS OF NEURONAL LOSS ASSOCIATED WITH STROKE, ISCHEMIA, CNS TRAUMA, HYPOGLYCEMIA AND SURGERY, NEURO-DEGENERATIVE DISEASES INCLUDING ALZHEIMER'S DISEASE, AMYOTROPHIC LATERAL SCLEROSIS, HUNTINGTON'S DISEASE WARNER-LAMBERT CO. 2001-04-17 US disclosed
WO-1997023458-A1 SUBTYPE-SELECTIVE NMDA RECEPTOR LIGANDS AND THE USE THEREOF WARNER-LAMBERT COMPANY (US) 1997-07-03 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 (2 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-20030144319-A1 Subtype-selective NMDA receptor ligands and the use thereof OPRK1, OPRD1, OPRL1 GRIN1 11/4885GRIN2B 8/4885LMNA 1213/4885
US-20010051633-A1 Subtype-selective NMDA receptor ligands and the use thereof OPRK1, OPRD1, OPRL1 GRIN1 11/4885GRIN2B 8/4885LMNA 1213/4885

“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.