SCHEMBL760402

SCHEMBL760402

COc1ccc(C2(c3ccc(OC(=O)Oc4ccc(-n5c(=O)c6cc7c(=O)n(-c8ccc(OC(C)=O)cc8)c(=O)c7cc6c5=O)cc4)cc3)CCCCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.49
POLB P06746 2/20 0.42
MAPT P10636 3/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 2/20 0.41
CYP2C9 P11712 1/20 0.41
KMT2A Q03164 1/20 0.41
GLA P06280 1/20 0.38
PDE10A Q9Y233 5/20 0.38
BACE1 P56817 1/20 0.36
ALDH1A1 P00352 3/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
HIF1A Q16665 1/20 0.36
NPC1 O15118 1/20 0.36
ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL759682 0.92 NPSR1 (0.43) NPSR1POLBMAPTLMNAHPGD
SCHEMBL19194913 0.85 KMT2A (0.51) POLBMAPTLMNAHPGDKDM4E
SCHEMBL12919554 0.82 KMT2A (0.48) POLBMAPTLMNAHPGDKDM4E
SCHEMBL12404386 0.82 KMT2A (0.48) POLBMAPTLMNAHPGDKDM4E
SCHEMBL13986180 0.82 KMT2A (0.48) POLBMAPTLMNAHPGDKDM4E
SCHEMBL279321 0.82 MAPT (0.54) POLBMAPTLMNAHPGDKDM4E
SCHEMBL15179068 0.82 MAPT (0.54) POLBMAPTLMNAHPGDKDM4E
SCHEMBL26009190 0.82 MAPT (0.54) POLBMAPTLMNAHPGDKDM4E
SCHEMBL19268519 0.82 MAPT (0.54) POLBMAPTLMNAHPGDKDM4E
SCHEMBL14339226 0.81 KMT2A (0.46) POLBMAPTLMNAHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8426092-B2 Poly(imide-carbonate) polytetrafluoroethylene containing photoconductors XEROX CORPORATION (US) 2013-04-23 US disclosed
US-20120070769-A1 INTERMEDIATE TRANSFER MEMBER XEROX CORPORATION (US) 2012-03-22 US disclosed
US-8138300-B1 Intermediate transfer member XEROX CORPORATION (US) 2012-03-20 US disclosed
US-20120052426-A1 POLY(IMIDE-CARBONATE) POLYTETRAFLUOROETHYLENE CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2012-03-01 US disclosed