SCHEMBL7266760

SCHEMBL7266760

C[Si](C)(C)CCOC(=O)c1ccc(-c2c3nc(c(-c4c(F)c(F)c(F)c(F)c4F)c4ccc([nH]4)c(-c4ccccc4)c4nc(c(-c5c(F)c(F)c(F)c(F)c5F)c5ccc2[nH]5)C=C4)C=C3)cc1.[MgH2]

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 3/20 0.48
▸ CYCS P99999 4/20 0.47
▸ ABCG2 Q9UNQ0 1/20 0.42
▸ TERT O14746 3/20 0.38
▸ ENPP2 Q13822 1/20 0.37
▸ NPC1 O15118 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 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
SCHEMBL7268825 0.99 TOP1 (0.49) TOP1CYCSABCG2TERTENPP2
SCHEMBL7268027 0.92 TOP1 (0.45) TOP1CYCSABCG2TERTENPP2
SCHEMBL6938676 0.91 TOP1 (0.46) TOP1CYCSABCG2TERTENPP2
SCHEMBL6687798 0.79 TOP1 (0.61) TOP1CYCSABCG2ENPP2NPC1
SCHEMBL13609842 0.77 TOP1 (0.53) TOP1CYCSABCG2TERTENPP2
SCHEMBL12733626 0.77 TOP1 (0.81) TOP1CYCSABCG2TERTENPP2
SCHEMBL25046485 0.76 TOP1 (0.66) TOP1CYCSABCG2TERTENPP2
SCHEMBL3788647 0.76 TOP1 (0.66) TOP1CYCSABCG2TERTENPP2
SCHEMBL30925006 0.76 TOP1 (0.66) TOP1CYCSABCG2TERTENPP2
SCHEMBL29684671 0.75 TOP1 (0.64) TOP1CYCSABCG2TERTENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6603070-B2 Convergent method for the synthesis of light harvesting rods. The rods are oligomers of the formula A1(Ab+1)b, wherein b is at least 1, A1 through Ab+1 are covalently coupled rod segments, and each rod segment A1 through A1+b comprises a NORTH CAROLINA STATE UNIVERSITY 2003-08-05 — — US disclosed
US-20030111108-A1 Convergent synthesis of multiporphyrin light-harvesting rods UNITED STATES DEPARTMENT OF ENERGY 2003-06-19 — — US disclosed
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