SCHEMBL6535064

SCHEMBL6535064

CCCCCc1c2nc(c(CCCCC)c3ccc([nH]3)c(-c3ccc(I)cc3)c3nc(c(CCCCC)c4ccc1[nH]4)C=C3)C=C2

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 5/20 0.46
▸ TOP1 P11387 4/20 0.43
▸ CYCS P99999 3/20 0.42
▸ ABCG2 Q9UNQ0 1/20 0.42
▸ ENPP2 Q13822 1/20 0.41
▸ GCGR P47871 3/20 0.35

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
SCHEMBL10614661 0.88 TOP1 (0.56) TERTTOP1CYCSABCG2ENPP2
SCHEMBL8198888 0.88 TERT (0.46) TERTTOP1CYCSABCG2ENPP2
SCHEMBL9231247 0.87 TERT (0.48) TERTTOP1CYCSABCG2ENPP2
SCHEMBL12893301 0.85 TERT (0.44) TERTTOP1CYCSABCG2ENPP2
SCHEMBL12893302 0.84 TERT (0.43) TERTTOP1CYCSABCG2ENPP2
SCHEMBL12893303 0.84 TERT (0.43) TERTTOP1CYCSABCG2ENPP2
SCHEMBL5586493 0.84 TERT (0.43) TERTTOP1CYCSABCG2ENPP2
SCHEMBL17681581 0.84 CCNB2 (0.50) TERTTOP1CYCSABCG2ENPP2
SCHEMBL17681577 0.84 CCNB2 (0.50) TERTTOP1CYCSABCG2ENPP2
SCHEMBL1194293 0.84 KCNH2 (0.39) TERT

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-6777516-B2 POLYMERS COMPRISED OF SANDWICH COORDINATION COMPOUNDS, SUCH AS EU OR CE COORDINATED PORPHYRINS AND PHTHALOCYANINES; ELECTROCHROMIC DISPLAYS, MOLECULAR CAPACITORS, AND BATTERIES. NORTH CAROLINA STATE UNIVERSITY 2004-08-17 — — US disclosed
US-6728129-B2 Multistate triple-decker dyads in three distinct architectures for information storage applications THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-04-27 — — US disclosed
US-20030169618-A1 Multistate triple-decker dyads in three distinct architectures for information storage applications THE REGENTS OF THE UNIVERSITY OF CALIFORNIA OFFICE OF TECHNOLOGY TRANSFER 2003-09-11 — — US disclosed
US-20030104229-A1 Substrates carrying polymers of linked sandwich coordination compounds and methods of use thereof LI JUNZHONG (US) 2003-06-05 — — US disclosed
US-6451942-B1 MIXED PHTHALOCYANINATO-PORPHYRINATO EUROPIUM(III) TRIPLE-DECKER SANDWICH COMPLEXES FOR MEMORY DEVICES NORTH CAROLINA STATE UNIVERSITY 2002-09-17 — — US disclosed
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