SCHEMBL1306816

SCHEMBL1306816

CC(CCCC=C(COc1cccc2ccccc12)C(=O)NCCC1=CCCCC1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.45
▸ HPGD P15428 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ POLB P06746 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ BCHE P06276 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ MAPT P10636 1/20 0.41

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
SCHEMBL1305885 0.88 ALDH1A1 (0.49) LMNAL3MBTL1ALDH1A1HPGDKDM4E
SCHEMBL1306596 0.85 ADAMTS5 (0.39) LMNAALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL1306597 0.85 PLAAT3 (0.39) LMNAALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL1305819 0.84 TDP1 (0.50) LMNAL3MBTL1ALDH1A1HPGDKDM4E
SCHEMBL28392351 0.84 TDP1 (0.50) LMNAL3MBTL1ALDH1A1HPGDKDM4E
SCHEMBL1306111 0.83 PTPN1 (0.46) LMNAALDH1A1HPGDPOLBMEN1
SCHEMBL1306562 0.83 HPGD (0.44) LMNAALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL1308956 0.81 ALDH1A1 (0.40) LMNAALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL1305963 0.80 KDM4E (0.45) LMNAL3MBTL1ALDH1A1HPGDKDM4E
SCHEMBL1307181 0.79 ALDH1A1 (0.43) LMNAALDH1A1HPGDKDM4ETDP1

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-8053435-B2 Naphthalenyloxypropenyl derivatives having inhibitory activity against histone deacetylase and pharmaceutical composition comprising the same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2011-11-08 — — US disclosed
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