SCHEMBL13827386

SCHEMBL13827386

CCC1=Cc2cc3c(cc2C1=C(C#N)C#N)C=C(C)C3=C(C#N)C#N

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
SCHEMBL11892863 0.92 EGFR (0.30) —
SCHEMBL9963863 0.87 EGFR (0.33) —
SCHEMBL12019769 0.82 — —
SCHEMBL15686201 0.78 — —
SCHEMBL18975441 0.76 — —
SCHEMBL15276700 0.68 — —
SCHEMBL12188710 0.66 EGFR (0.31) —
SCHEMBL9961322 0.66 — —
SCHEMBL15277912 0.61 CYP2A6 (0.36) —
SCHEMBL11892871 0.60 MAPT (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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150171332-A1 POLYMERIC BLENDS AND RELATED OPTOELECTRONIC DEVICES RAYNERGY TEK INC. (TW) 2015-06-18 — — US disclosed
US-9029695-B2 Heteroaromatic semiconducting polymers RAYNERGY TEK INC. (TW) 2015-05-12 — — US disclosed
US-20140353628-A1 Heteroaromatic Semiconducting polymers RAYNERGY TEK INC. (TW) 2014-12-04 — — US disclosed
US-8835598-B2 Conjugated polymers and their use in optoelectronic devices POLYERA CORPORATION (US) 2014-09-16 — — US disclosed
US-8748739-B2 Conjugated polymers and their use in optoelectronic devices POLYERA CORPORATION (US) 2014-06-10 — — US disclosed
US-8664339-B2 Organic semiconducting polymers POLYERA CORPORATION (US) 2014-03-04 — — US disclosed
US-8569501-B2 Semiconductor materials and methods of preparation and use thereof BASF SE (DE) 2013-10-29 — — US disclosed
US-20130248831-A1 Conjugated Polymers and Their Use in Optoelectronic Devices POLYERA CORPORATION (US) 2013-09-26 — — US disclosed
US-8470961-B2 Naphtalene-imide semiconductor polymers BASF SE (DE) 2013-06-25 — — US disclosed
US-20120289672-A1 DITHIENOBENZO-THIENO[3,2-B]THIOPHENE-COPOLYMER AND ITS USE AS HIGH PERFORMANCE SOLUTION PROCESSABLE SEMICONDUCTING POLYMER MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2012-11-15 — — US disclosed
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