SCHEMBL1946312

SCHEMBL1946312

CC1=C2C=CC(=N2)C(C)=C2C=CC(=N2)C(C)=C2C=CC(=N2)C(C)=C2C=CC1=N2

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL4017054 0.61 KDM4E (0.30) —
SCHEMBL49743 0.51 MAOA (0.37) —
SCHEMBL8733374 0.50 IDO1 (0.33) —
SCHEMBL895221 0.47 — —
SCHEMBL399620 0.47 — —
SCHEMBL18205013 0.45 — —
SCHEMBL11218163 0.45 ACHE (0.30) —
SCHEMBL15484301 0.44 — —
P-Xylene SCHEMBL33600 0.44 — —
SCHEMBL991281 0.43 TSHR (0.33) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110136774-A1 Anti-Apoptotic Benzodiazepine Receptor Ligand Inhibitors MALFROY-CAMINE BERNARD 2011-06-09 — — US disclosed
US-20100120738-A1 ANTI-APOPTOTIC BENZODIAZEPINE RECEPTOR LIGAND INHIBITORS MALFROY-CAMINE BERNARD 2010-05-13 — — US disclosed
US-7649091-B2 complex comprising manganese acetate and {[{(Porphine-5,15-diyl)bis[cyclopropyl-diyl]}](2-)-N21,N22,N23, N24 }; reduce damage to cells; preventing or arresting free radical associated diseases or conditions; free radical scavengers EUKARION, INC. (US) 2010-01-19 — — US disclosed
WO-2008033444-A2 ANTI-APOPTOTIC BENZODIAZEPINE RECEPTOR LIGAND INHIBITORS EUKARION, INC. (US) 2008-03-20 — — WO disclosed
US-20060241095-A1 Orally bioavailable low molecular weight metalloporphyrins as antioxidants EUKARION, INC. 2006-10-26 — — US disclosed
EP-1631572-A2 ORALLY BIOAVAILABLE LOW MOLECULAR WEIGHT METALLOPORPHYRINS AS ANTIOXIDANTS EUKARION, INC. (US) 2006-03-08 — — EP disclosed
WO-2005000854-A2 ORALLY BIOAVAILABLE LOW MOLECULAR WEIGHT METALLOPORPHYRINS AS ANTIOXIDANTS EUKARION, INC. (US) 2005-01-06 — — WO disclosed
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