SCHEMBL14430864

SCHEMBL14430864

CBC(C)(C)c1ccccc1F

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.37
▸ KCNN4 O15554 5/20 0.36
▸ ALDH1A1 P00352 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ SLC22A12 Q96S37 2/20 0.33
▸ KCNE1 P15382 1/20 0.33
▸ KCNQ1 P51787 1/20 0.33
▸ HSD11B1 P28845 2/20 0.31
▸ NFE2L2 Q16236 1/20 0.31
▸ RIPK1 Q13546 1/20 0.31
▸ KIF11 P52732 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
SCHEMBL179259 0.75 ALDH1A1 (0.50) ACHEKCNN4ALDH1A1TSHRTDP1
SCHEMBL7935323 0.75 ACHE (0.43) ACHEKCNN4ALDH1A1TSHRTDP1
SCHEMBL11415516 0.73 ACHE (0.42) ACHEKCNN4ALDH1A1TSHRTDP1
SCHEMBL27660687 0.73 ALDH1A1 (0.48) ACHEKCNN4ALDH1A1TSHRTDP1
SCHEMBL27726574 0.73 ACHE (0.42) ACHEKCNN4ALDH1A1TSHRTDP1
SCHEMBL20076543 0.73 ACHE (0.42) ACHEKCNN4ALDH1A1TSHRTDP1
SCHEMBL14489030 0.72 KIF11 (0.38) KCNN4ALDH1A1TDP1KCNE1KCNQ1
SCHEMBL24826099 0.71 KCNN4 (0.42) ACHEKCNN4ALDH1A1TSHRTDP1
SCHEMBL10929384 0.71 ACHE (0.40) ACHEKCNN4ALDH1A1TSHRTDP1
SCHEMBL3674130 0.71 KCNN4 (0.42) ACHEKCNN4ALDH1A1TSHRTDP1

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
EP-1728838-B1 Ink composition for ink jet-recording and method for preparing lithographic printing plate using the same FUJIFILM CORP (JP) 2007-08-15 — — EP disclosed
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