SCHEMBL16775320

SCHEMBL16775320

COc1ccc(C2(c3ccc(OC(=O)c4ccc(C)cc4)cc3)CCCCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.51
SLC6A4 P31645 1/20 0.51
SLC6A3 Q01959 1/20 0.51
KDM4E B2RXH2 4/20 0.50
HPGD P15428 2/20 0.50
LMNA P02545 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KMT2A Q03164 5/20 0.46
MAPT P10636 4/20 0.46
PRSS1 P07477 2/20 0.46
ACR P10323 2/20 0.46
GFER P55789 1/20 0.46
ADORA3 P0DMS8 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44

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
SCHEMBL13864906 0.92 TDP1 (0.53) SLC6A2SLC6A4SLC6A3KDM4EHPGD
SCHEMBL139339 0.91 CA1 (0.57) KDM4EHPGDLMNASMN1; SMN2CYP2C9
SCHEMBL16784756 0.90 ESR1 (0.53) SLC6A2SLC6A4SLC6A3KDM4EHPGD
SCHEMBL12345968 0.90 KMT2A (0.48) KDM4EHPGDLMNASMN1; SMN2CYP2C9
SCHEMBL13030420 0.89 TDP1 (0.49) SLC6A2SLC6A4SLC6A3KDM4EHPGD
SCHEMBL2718813 0.88 KMT2A (0.50) SLC6A2SLC6A4SLC6A3LMNASMN1; SMN2
SCHEMBL14877709 0.88 KDM4E (0.47) SLC6A4SLC6A3KDM4EHPGDLMNA
SCHEMBL14580087 0.86 LMNA (0.50) SLC6A2SLC6A4SLC6A3LMNASMN1; SMN2
SCHEMBL18567135 0.86 ESR1 (0.49) SLC6A2SLC6A4SLC6A3KDM4EHPGD
SCHEMBL19863504 0.86 KMT2A (0.45) KDM4EHPGDLMNASMN1; SMN2CYP2C9

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
US-9052645-B2 Polyarylatecarbonate intermediate transfer members XEROX CORPORATION (US) 2015-06-09 US disclosed