SCHEMBL8035878

SCHEMBL8035878

CCCCc1cnc(-c2ccc(OCC)cc2)nc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.62
MAPT P10636 5/20 0.62
L3MBTL1 Q9Y468 2/20 0.62
NPC1 O15118 6/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
KDM4E B2RXH2 4/20 0.58
HSD17B10 Q99714 2/20 0.58
RARB P10826 1/20 0.55
ALDH1A1 P00352 3/20 0.51
MEN1 O00255 1/20 0.51
USP2 O75604 1/20 0.51
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.51
KMT2A Q03164 1/20 0.51
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
TP53 P04637 1/20 0.46
THRB P10828 1/20 0.46

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
SCHEMBL9477779 0.94 RAB9A (0.68) RAB9AMAPTL3MBTL1NPC1SMN1; SMN2
SCHEMBL8559935 0.94 RAB9A (0.68) RAB9AMAPTL3MBTL1NPC1SMN1; SMN2
SCHEMBL10691440 0.93 RAB9A (0.59) RAB9AMAPTL3MBTL1NPC1SMN1; SMN2
SCHEMBL7507171 0.90 MAPT (0.54) RAB9AMAPTL3MBTL1NPC1SMN1; SMN2
SCHEMBL10692972 0.89 RAB9A (0.65) RAB9AMAPTL3MBTL1NPC1SMN1; SMN2
SCHEMBL9238066 0.88 RAB9A (0.63) RAB9AMAPTL3MBTL1NPC1SMN1; SMN2
SCHEMBL11152150 0.88 RAB9A (0.63) RAB9AMAPTL3MBTL1NPC1SMN1; SMN2
SCHEMBL10688526 0.87 RAB9A (0.64) RAB9AMAPTL3MBTL1NPC1SMN1; SMN2
SCHEMBL10693734 0.87 RAB9A (0.64) RAB9AMAPTL3MBTL1NPC1SMN1; SMN2
SCHEMBL10691554 0.87 RAB9A (0.64) RAB9AMAPTL3MBTL1NPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0700982-B1 A liquid crystal composition and a liquid crystal display element using the same CHISSO CORP (JP) 2000-04-26 EP disclosed
EP-0672742-B1 A hexenediyne derivative and a liquid crystal composition CHISSO CORP (JP) 1999-02-10 EP disclosed
EP-0700982-A1 A liquid crystal composition and a liquid crystal display element using the same Chisso Corporation (JP) 1996-03-13 EP disclosed
EP-0672742-A1 A hexenediyne derivative and a liquid crystal composition CHISSO CORPORATION (JP) 1995-09-20 EP disclosed