SCHEMBL17312023

SCHEMBL17312023

CC(=O)Oc1c(C)c(I)cc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.49
▸ MAPT P10636 3/20 0.49
▸ HTT P42858 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ BACE1 P56817 1/20 0.40
▸ TOP1 P11387 1/20 0.39
▸ GRIN2D O15399 1/20 0.39
▸ GRIN2A Q12879 1/20 0.39
▸ GRIN2C Q14957 1/20 0.39
▸ ALDH1A1 P00352 5/20 0.38
▸ POLB P06746 1/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HPGD P15428 3/20 0.38

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
SCHEMBL6755866 0.83 KDM4E (0.58) KDM4EMAPTHTTGAAHSD17B10
SCHEMBL4752091 0.81 KDM4E (0.54) KDM4EMAPTHTTGAAHSD17B10
SCHEMBL6618712 0.81 KDM4E (0.49) KDM4EMAPTHTTGAAHSD17B10
SCHEMBL13666895 0.77 KDM4E (0.62) KDM4EMAPTHTTGAAHSD17B10
SCHEMBL8582319 0.76 KDM4E (0.59) KDM4EMAPTHTTGAAHSD17B10
SCHEMBL27367553 0.75 KDM4E (0.53) KDM4EMAPTHTTGAAHSD17B10
SCHEMBL9713872 0.74 KDM4E (0.59) KDM4EMAPTHTTGAAHSD17B10
SCHEMBL8107317 0.74 KDM4E (0.50) KDM4EMAPTHTTGAAHSD17B10
SCHEMBL27615297 0.74 KDM4E (0.51) KDM4EMAPTHTTGAAHSD17B10
SCHEMBL453345 0.73 KDM4E (0.58) KDM4EMAPTHTTGAAHSD17B10

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-20150351517-A1 HAIR COLOURING KIT CONOPCO, INC.,D/B/A UNILEVER (US) 2015-12-10 — — US disclosed
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