SCHEMBL224501

SCHEMBL224501

C1=Cc2cc3[nH]c(c(-c4ccc5ccc6cccc7ccc4c5c67)c4nc(cc5ccc(cc1n2)[nH]5)C=C4c1ccc2ccc4cccc5ccc1c2c45)c(-c1ccc2ccc4cccc5ccc1c2c45)c3-c1ccc2ccc3cccc4ccc1c2c34

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
SCHEMBL4320778 0.87 BCHE (0.36) —
SCHEMBL10609089 0.85 STAT3 (0.30) —
SCHEMBL226506 0.84 STAT3 (0.35) —
SCHEMBL5075306 0.83 — —
SCHEMBL270828 0.77 MGAM (0.33) —
SCHEMBL38285 0.77 NPC1 (0.33) —
SCHEMBL6513344 0.77 STAT3 (0.34) —
SCHEMBL9764162 0.76 STAT3 (0.31) —
SCHEMBL9764619 0.76 KDM4E (0.32) —
SCHEMBL11324162 0.76 NPBWR1 (0.30) —

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-10256421-B2 Fusing porphyrins with polycyclic aromatic hydrocarbons and heterocycles for optoelectronic applications UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2019-04-09 — — US disclosed
US-20170092883-A1 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRONIC APPLICATIONS UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2017-03-30 — — US disclosed
US-20150280149-A1 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRONIC APPLICATIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2015-10-01 — — US disclosed
US-9113535-B2 Fusing porphyrins with polycyclic aromatic hydrocarbons and heterocycles for optoelectronic applications THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2015-08-18 — — US disclosed
EP-2590983-A2 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRIC APPLICATIONS The University Of Southern California (US) 2013-05-15 — — EP disclosed
WO-2012012117-A2 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRIC APPLICATIONS The University of Southern California USC Stevens Institute for Innovation (US) 2012-01-26 — — WO disclosed
US-20120001155-A1 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRONIC APPLICATIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-01-05 — — US disclosed
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