SCHEMBL9508386

SCHEMBL9508386

O=C(O)c1cccc(C2CCCCC2)c1C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.45
ACMSD Q8TDX5 2/20 0.45
NOTUM Q6P988 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
CAMKK2 Q96RR4 4/20 0.39
ALDH1A1 P00352 3/20 0.39
ALOX15 P16050 1/20 0.39
CAMKK1 Q8N5S9 3/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
CXCR5 P32302 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ABCC1 P33527 1/20 0.38
GLA P06280 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL28140772 1.00 KMO (0.46) KMOPTGDR2ACMSDNOTUMSLC6A2
SCHEMBL4395937 0.91 NOTUM (0.47) NOTUMSLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL4827205 0.89 KMO (0.51) KMOPTGDR2ACMSDALDH1A1ALOX15
SCHEMBL28774186 0.85 PTGDR2 (0.41) KMOPTGDR2ACMSDSLC6A2SLC6A4
SCHEMBL1004217 0.85 MEN1 (0.49) PTGDR2SLC6A2SLC6A4SLC6A3MAPT
SCHEMBL10790290 0.84 ACMSD (0.50) KMOPTGDR2ACMSDCAMKK2ALDH1A1
SCHEMBL10790137 0.84 ACMSD (0.50) KMOPTGDR2ACMSDCAMKK2ALDH1A1
SCHEMBL300805 0.84 ACMSD (0.50) KMOPTGDR2ACMSDCAMKK2ALDH1A1
SCHEMBL31011018 0.84 ACMSD (0.50) KMOPTGDR2ACMSDCAMKK2ALDH1A1
SCHEMBL9403931 0.84 ACMSD (0.50) KMOPTGDR2ACMSDCAMKK2ALDH1A1

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
EP-0549808-A1 TRANSPARENT PLASTIC MATERIAL SEIKO EPSON CORPORATION (JP) 1993-07-07 EP disclosed