SCHEMBL7251644

SCHEMBL7251644

OCCCCCN1CCCC(Cc2ccccc2)C1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CARM1 Q86X55 2/20 0.62
▸ PRMT6 Q96LA8 2/20 0.62
▸ BCHE P06276 1/20 0.54
▸ KCNH2 Q12809 1/20 0.52
▸ CCR3 P51677 3/20 0.51
▸ SIGMAR1 Q99720 1/20 0.51
▸ HTR2A P28223 2/20 0.49
▸ SLC6A2 P23975 1/20 0.48
▸ SLC6A4 P31645 1/20 0.48
▸ CHRNB2 P17787 3/20 0.47
▸ CHRNA4 P43681 3/20 0.47
▸ CHRNB4 P30926 2/20 0.47
▸ CHRNA3 P32297 2/20 0.47
▸ CYP2D6 P10635 1/20 0.47

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
SCHEMBL7248608 0.99 CARM1 (0.64) CARM1PRMT6BCHEKCNH2CCR3
SCHEMBL12040805 0.86 KCNH2 (0.71) CARM1PRMT6BCHEKCNH2CCR3
Bromide SCHEMBL7250389 0.85 SIGMAR1 (0.68) CARM1PRMT6BCHECCR3SIGMAR1
Bromide SCHEMBL7251275 0.83 CARM1 (0.65) CARM1PRMT6BCHECCR3SIGMAR1
SCHEMBL7248136 0.83 KCNH2 (0.74) CARM1PRMT6KCNH2CCR3SIGMAR1
SCHEMBL29244363 0.83 KCNH2 (0.74) CARM1PRMT6KCNH2CCR3SIGMAR1
SCHEMBL12041254 0.83 CARM1 (0.64) CARM1PRMT6BCHEKCNH2CCR3
SCHEMBL12041275 0.82 KCNH2 (0.64) CARM1PRMT6BCHEKCNH2CCR3
SCHEMBL12041337 0.82 CARM1 (0.63) CARM1PRMT6BCHEKCNH2CCR3
SCHEMBL29244366 0.81 CCR3 (0.75) CARM1PRMT6KCNH2CCR3SIGMAR1

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 CARM1 1889/4885PRMT6 3340/4885BCHE 523/4885
US-20010051633-A1 Subtype-selective NMDA receptor ligands and the use thereof OPRK1, OPRD1, OPRL1 CARM1 1889/4885PRMT6 3340/4885BCHE 523/4885

“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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