SCHEMBL14430860

SCHEMBL14430860

CCCCBC(C)(C)c1ccccc1F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ KCNN4 O15554 2/20 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
SCHEMBL14430874 0.93 SMN1; SMN2 (0.33) HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL14489030 0.77 KIF11 (0.38) SMN1; SMN2KCNN4
SCHEMBL14430856 0.76 L3MBTL1 (0.31) L3MBTL1
SCHEMBL19059646 0.73 SMN1; SMN2 (0.35) HDAC3HDAC1HDAC2SMN1; SMN2L3MBTL1
SCHEMBL26053254 0.71 SMN1; SMN2 (0.36) HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL14430864 0.71 ACHE (0.37) HDAC3HDAC1HDAC2KCNN4
SCHEMBL22435799 0.70 CNR2 (0.41) SMN1; SMN2
SCHEMBL9777283 0.69 KCNN4 (0.36) KCNN4
SCHEMBL21339358 0.69 SMN1; SMN2 (0.35) HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL30526183 0.69 HSP90AA1 (0.42) HDAC3HDAC1HDAC2SMN1; SMN2KCNN4

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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