SCHEMBL20705304

SCHEMBL20705304

C[n+]1ccc(-c2c3nc(c(-c4cc[n+](C)cc4)c4ccc([nH]4)c(-c4c(F)c(F)c(F)c(F)c4F)c4nc(c(-c5cc[n+](C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 6/20 0.78
▸ TOP1 P11387 2/20 0.44
▸ CYCS P99999 2/20 0.43
▸ ENPP2 Q13822 1/20 0.43

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
Tmpyp4 SCHEMBL265519 0.89 TERT (0.97) TERTTOP1CYCSENPP2
Tmpyp4 SCHEMBL29369473 0.88 TERT (1.00) TERTTOP1CYCSENPP2
Tmpyp4 SCHEMBL20380171 0.88 TERT (0.93) TERTTOP1CYCSENPP2
SCHEMBL20380012 0.84 TERT (0.85) TERTTOP1CYCSENPP2
SCHEMBL20379925 0.84 TERT (0.85) TERTTOP1CYCSENPP2
SCHEMBL20380004 0.84 TERT (0.85) TERTTOP1CYCSENPP2
SCHEMBL29582816 0.83 TERT (0.47) TERTTOP1CYCSENPP2
SCHEMBL29648942 0.83 TERT (0.47) TERTTOP1CYCSENPP2
SCHEMBL29353372 0.83 TERT (0.47) TERTTOP1CYCSENPP2
SCHEMBL174717 0.83 TERT (0.47) TERTTOP1CYCSENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019025808-A1 IMPROVED BIOREACTORS UNIVERSITY OF STRATHCLYDE (GB) 2019-02-07 — — WO disclosed
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