SCHEMBL8918948

SCHEMBL8918948

[CH2]CCCCOc1c(Cl)cccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
L3MBTL1 Q9Y468 6/20 0.45
HPGD P15428 2/20 0.45
KDM4E B2RXH2 1/20 0.41
HTR1A P08908 2/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
MAPT P10636 3/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 1/20 0.35
KCNH2 Q12809 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL8778511 0.98 KMT2A (0.44) KMT2AL3MBTL1HPGDKDM4EHTR1A
SCHEMBL6474960 0.87 KMT2A (0.48) KMT2AL3MBTL1HPGDKDM4EHTR1A
SCHEMBL10461262 0.80 KMT2A (0.50) KMT2AL3MBTL1HPGDKDM4EHTR1A
SCHEMBL1575727 0.78 KMT2A (0.52) KMT2AL3MBTL1HPGDKDM4EHTR1A
SCHEMBL11450595 0.78 KMT2A (0.44) KMT2AL3MBTL1HPGDKDM4EHTR1A
SCHEMBL20414593 0.78 L3MBTL1 (0.51) KMT2AL3MBTL1HPGDKDM4EHTR1A
SCHEMBL8955990 0.78 KMT2A (0.48) KMT2AL3MBTL1HPGDKDM4EHTR1A
SCHEMBL4055640 0.78 KMT2A (0.44) KMT2AL3MBTL1HPGDKDM4EHTR1A
SCHEMBL9026333 0.78 L3MBTL1 (0.59) KMT2AL3MBTL1HPGDMAPTMAPK1
SCHEMBL8778502 0.77 TDP1 (0.54) KMT2AL3MBTL1KDM4EMAPTSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5591751-A CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-01-07 US disclosed
EP-0636128-A1 PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-02-01 EP disclosed
WO-1994019339-A1 PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO disclosed