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SCHEMBL8059031

SCHEMBL8059031

Nc1c(Cl)c(Cl)c(-c2c(Cl)c(Cl)c(N)c(Cl)c2Cl)c(Cl)c1Cl.Nc1c(Cl)c(Cl)c(-c2c(Cl)c(N)c(Cl)c(Cl)c2Cl)c(Cl)c1Cl

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ UCHL1 P09936 1/20 0.32
▸ UCHL3 P15374 1/20 0.32
▸ ECE1 P42892 1/20 0.32
▸ MUS81 Q96NY9 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ TSHR P16473 1/20 0.32

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
SCHEMBL7869952 1.00 CA1 (0.33) CA1CA2CA4UCHL1UCHL3
SCHEMBL8059878 1.00 CA1 (0.33) CA1CA2CA4UCHL1UCHL3
Water SCHEMBL7869975 0.97 CA1 (0.32) CA1CA2CA4UCHL1UCHL3
SCHEMBL7869956 0.93 CA1 (0.36) CA1CA2CA4ALDH1A1
SCHEMBL6449656 0.81 CA1 (0.32) CA1CA2CA4ALDH1A1TSHR
SCHEMBL3341501 0.81 CA1 (0.32) CA1CA2CA4ALDH1A1TSHR
SCHEMBL2204192 0.80 ALDH1A1 (0.35) CA1CA2CA4ALDH1A1
SCHEMBL38652792 0.77 CA1 (0.31) CA1CA2CA4ALDH1A1
SCHEMBL4705260 0.76 ALDH1A1 (0.33) CA1CA2CA4ALDH1A1TSHR
SCHEMBL29674828 0.76 ALDH1A1 (0.33) CA1CA2CA4ALDH1A1TSHR

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
US-6031061-A Bis (triaklyltrimellitic anhydride) derivative and polyesterimide for optical communications formed therefrom SAMSUNG ELECTRONICS CO., LTD. (KR) 2000-02-29 — — US disclosed