SCHEMBL22991491

SCHEMBL22991491

OCCc1ccc(I)c(O)c1I

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.33
▸ HTR2C P28335 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ ALOX5 P09917 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ BACE1 P56817 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ TP53 P04637 1/20 0.30

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
SCHEMBL6559326 0.76 TYR (0.50) HTR2CKDM4EALDH1A1ALOX5MAPT
SCHEMBL22991646 0.76 TSHR (0.31) —
SCHEMBL16124487 0.75 IAPP (0.50) KDM4EALDH1A1MAPTTP53
SCHEMBL22991494 0.74 TP53 (0.41) HTR2CKDM4EALDH1A1ALOX5GAA
SCHEMBL22288171 0.71 TAAR1 (0.40) CA2HTR2CTDP1
SCHEMBL4958950 0.70 TTR (0.38) —
SCHEMBL14484747 0.69 CYP4F2 (0.51) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL22288324 0.67 HTR2C (0.35) CA2HTR2CKDM4EALDH1A1ALOX5
SCHEMBL12302293 0.66 TTR (0.44) CA2KDM4EALDH1A1MAPTTDP1
SCHEMBL606046 0.66 PIM1 (0.38) CA2ALDH1A1TDP1

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-2021029395-A1 COMPOUND, POLYMER, COMPOSITION, COMPOSITION FOR FILM FORMATION, PATTERN FORMING METHOD, METHOD FOR FORMING INSULATING FILM, METHOD FOR PRODUCING COMPOUND, IODINE-CONTAINING VINYL POLYMER AND METHOD FOR PRODUCING ACETYLATED DERIVATIVE OF SAME 三菱瓦斯化学株式会社 2021-02-18 — — WO disclosed
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