SCHEMBL8069428

SCHEMBL8069428

CCCCc1ccc(-c2ncc(CCC)cn2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.64
SMN1; SMN2 Q16637 8/20 0.64
MAPT P10636 5/20 0.64
ALDH1A1 P00352 3/20 0.64
KDM4E B2RXH2 3/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
HSD17B10 Q99714 2/20 0.64
USP2 O75604 1/20 0.64
GAA P10253 1/20 0.64
HPGD P15428 1/20 0.64
RARB P10826 4/20 0.59
NPC1 O15118 8/20 0.51
NFKB1 P19838 4/20 0.51
NFKB2 Q00653 3/20 0.51
RELA Q04206 3/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
MAPK1 P28482 1/20 0.51
S1PR1 P21453 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL14525790 0.98 RAB9A (0.62) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL9637497 0.98 RAB9A (0.62) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL8083682 0.96 RAB9A (0.68) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL7900524 0.95 RAB9A (0.71) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL7908259 0.95 RAB9A (0.71) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL8083723 0.93 RAB9A (0.73) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL8081783 0.93 RAB9A (0.73) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL7907395 0.93 RAB9A (0.57) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL9637358 0.92 MAPT (0.72) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL10500474 0.92 RAB9A (0.68) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0805134-B1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORP (JP) 2000-08-30 EP disclosed
US-6086964-A Liquid crystalline compound having dienyl moiety and liquid crystal composition CHISSO CORPORATION (JP) 2000-07-11 US disclosed
EP-0494368-B1 Supertwist liquid crystal display MERCK PATENT GMBH (DE) 1999-01-20 EP disclosed
CN-1169138-A Novel liquid crystal compound bearing dienyl moiety and liquid crystal composition CHISSO CORP (JP) 1997-12-31 CN disclosed
EP-0805134-A1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-11-05 EP disclosed
EP-0494368-A2 Supertwist liquid crystal display MERCK PATENT GmbH (DE) 1992-07-15 EP disclosed