SCHEMBL1307207

SCHEMBL1307207

COC(=O)c1ccc(/C=C(\COc2cccc3ccccc23)C(=O)NCCc2ccc(F)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ TDP1 Q9NUW8 2/20 0.41
▸ MGLL Q99685 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ GAA P10253 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ PLAAT3 P53816 1/20 0.39
▸ PLAAT5 Q96KN8 1/20 0.39
▸ PLAAT2 Q9NWW9 1/20 0.39
▸ PLAAT4 Q9UL19 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ PTPN1 P18031 1/20 0.39

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
SCHEMBL1307099 0.92 PTPN1 (0.48) LMNAMAPTHTTALDH1A1KDM4E
SCHEMBL1307912 0.91 LMNA (0.51) LMNASMN1; SMN2TDP1MAPTHTT
SCHEMBL1307916 0.91 LMNA (0.51) LMNASMN1; SMN2TDP1MAPTHTT
SCHEMBL1306130 0.89 P2RX3 (0.46) LMNASMN1; SMN2MAPTHTTALDH1A1
SCHEMBL1306132 0.89 P2RX3 (0.46) LMNASMN1; SMN2MAPTHTTALDH1A1
SCHEMBL1306801 0.86 KDM4E (0.47) LMNASMN1; SMN2TDP1MAPTALDH1A1
SCHEMBL1306788 0.85 PTPN1 (0.48) LMNASMN1; SMN2MAPTHTTALDH1A1
SCHEMBL1306787 0.85 PTPN1 (0.48) LMNASMN1; SMN2MAPTHTTALDH1A1
SCHEMBL1307208 0.84 TRPM4 (0.41) LMNASMN1; SMN2TDP1MAPTHTT
SCHEMBL1306614 0.83 HDAC3 (0.47) LMNAMAPTALDH1A1GAAKDM4E

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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