SCHEMBL6692407

SCHEMBL6692407

CCCCN1CCCN(C(=O)c2ccc(OC)c(C(N)=O)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
HPGD P15428 3/20 0.51
HSD17B10 Q99714 1/20 0.51
ALDH1A1 P00352 5/20 0.50
POLB P06746 1/20 0.50
CYP2C19 P33261 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SLC29A1 Q99808 1/20 0.50
DRD3 P35462 2/20 0.49
KDM4E B2RXH2 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
DRD2 P14416 4/20 0.47
GAA P10253 2/20 0.46
MAPT P10636 1/20 0.46
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 1/20 0.46
HTR2A P28223 1/20 0.45

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
SCHEMBL6692232 0.92 KMT2A (0.49) KMT2AMEN1HPGDHSD17B10ALDH1A1
SCHEMBL6692413 0.87 KMT2A (0.53) KMT2AMEN1HPGDHSD17B10ALDH1A1
SCHEMBL6687434 0.86 HPGD (0.44) KMT2AMEN1HPGDALDH1A1SMN1; SMN2
SCHEMBL6692234 0.83 HTR4 (0.52) KMT2AMEN1ALDH1A1POLBSLC29A1
SCHEMBL6703688 0.80 PARP1 (0.49) KMT2AMEN1HPGDPOLBL3MBTL1
SCHEMBL6687780 0.79 PARP1 (0.46) KMT2AMEN1HPGDHSD17B10ALDH1A1
SCHEMBL6692575 0.79 LMNA (0.45) KMT2AHPGDALDH1A1DRD2TSHR
SCHEMBL6687439 0.77 HPGD (0.46) KMT2AMEN1HPGDALDH1A1SMN1; SMN2
SCHEMBL11938971 0.77 DRD2 (0.54) KMT2AMEN1HPGDALDH1A1POLB
SCHEMBL3069426 0.76 ALDH1A1 (0.56) KMT2AMEN1HPGDHSD17B10ALDH1A1

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
WO-2004074438-A2 CCR8 ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2004-09-02 WO claimed