SCHEMBL9515902

SCHEMBL9515902

CCCCCCCCOc1ccc(-c2ccc(OCC(C)OCC)nn2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 4/20 0.46
L3MBTL1 Q9Y468 4/20 0.46
HPGD P15428 3/20 0.46
HTT P42858 1/20 0.46
CYP2D6 P10635 6/20 0.41
CYP19A1 P11511 5/20 0.41
CYP2C9 P11712 4/20 0.41
CYP2C19 P33261 4/20 0.41
CYP1A2 P05177 3/20 0.41
RAB9A P51151 4/20 0.40
MAPT P10636 4/20 0.40
RARB P10826 3/20 0.40
NPC1 O15118 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
PKM P14618 2/20 0.40
MITF O75030 1/20 0.40
NR5A1 Q13285 1/20 0.40
CYP3A4 P08684 1/20 0.39
PLA2G2A P14555 1/20 0.38

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
SCHEMBL9514505 0.94 KDM4E (0.47) KDM4EALDH1A1L3MBTL1HPGDHTT
SCHEMBL9515878 0.94 KDM4E (0.47) KDM4EALDH1A1L3MBTL1HPGDHTT
SCHEMBL9514935 0.94 KDM4E (0.47) KDM4EALDH1A1L3MBTL1HPGDHTT
SCHEMBL9514957 0.94 KDM4E (0.47) KDM4EALDH1A1L3MBTL1HPGDHTT
SCHEMBL9512008 0.94 KDM4E (0.47) KDM4EALDH1A1L3MBTL1HPGDHTT
SCHEMBL9512626 0.89 KDM4E (0.44) KDM4EALDH1A1L3MBTL1HPGDHTT
SCHEMBL9515937 0.89 KDM4E (0.44) KDM4EALDH1A1L3MBTL1HPGDHTT
SCHEMBL9512654 0.88 L3MBTL1 (0.44) KDM4EALDH1A1L3MBTL1HPGDHTT
SCHEMBL9237754 0.86 L3MBTL1 (0.48) KDM4EALDH1A1L3MBTL1HPGDHTT
SCHEMBL9236991 0.86 L3MBTL1 (0.48) KDM4EALDH1A1L3MBTL1HPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0277815-B1 Optically active-2-alkoxy-propyl ether and liquid crystal composition CHISSO CORP (JP) 1993-11-24 EP disclosed
US-5021191-A Ferroelectricity display elements; extremely small redution in crystal temperature region CHISSO CORPORATION (JP) 1991-06-04 US disclosed