SCHEMBL2875412

SCHEMBL2875412

O=COc1c(-c2ccccc2)ccc2c1ccc1ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 4/20 0.44
ALDH1A1 P00352 3/20 0.41
CYP1A2 P05177 3/20 0.41
LMNA P02545 2/20 0.41
TP53 P04637 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C9 P11712 2/20 0.41
HPGD P15428 2/20 0.41
MAPK1 P28482 2/20 0.41
CYP2C19 P33261 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
USP2 O75604 1/20 0.41
ALOX12 P18054 1/20 0.41
HIF1A Q16665 1/20 0.41
PAX8 Q06710 1/20 0.38
TDP1 Q9NUW8 3/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP2A6 P11509 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
SCHEMBL28754680 0.92 MAPT (0.39) HPRT1ALDH1A1CYP1A2HPGDMEN1
SCHEMBL2874842 0.76 MAPT (0.40) HPRT1ALDH1A1CYP1A2LMNACYP2C9
SCHEMBL27792756 0.75 NPC1 (0.46) HPRT1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL668420 0.72 ALDH1A1 (0.44) HPRT1ALDH1A1CYP1A2LMNATP53
SCHEMBL27955470 0.72 HPRT1 (0.58) HPRT1ALDH1A1CYP1A2LMNATP53
SCHEMBL30958714 0.72 PIM1 (0.43) ALDH1A1HPGDMAPK1MEN1KMT2A
SCHEMBL443518 0.72 HPRT1 (0.64) HPRT1ALDH1A1CYP1A2LMNATP53
SCHEMBL27631995 0.72 HPRT1 (0.64) HPRT1ALDH1A1CYP1A2LMNATP53
SCHEMBL1758084 0.71 HPRT1 (0.52) HPRT1ALDH1A1CYP1A2LMNATP53
SCHEMBL2694363 0.71 HPRT1 (0.56) HPRT1ALDH1A1CYP1A2LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1945718-B1 COMPOSITION AND FILM FOR LIQUID CRYSTAL DISPLAYS FUJIFILM CORP (JP) 2010-10-20 EP disclosed
US-20090130344-A1 COMPOSITION, FILM AND LIQUID CRYSTAL DISPLAY FUJIFILM CORPORATION (JP) 2009-05-21 US disclosed
EP-1945718-A1 COMPOSITION, FILM AND LIQUID CRYSTAL DISPLAY FUJIFILM Corporation (JP) 2008-07-23 EP disclosed
WO-2007055417-A1 COMPOSITION, FILM AND LIQUID CRYSTAL DISPLAY FUJIFILM CORPORATION (JP) 2007-05-18 WO disclosed
US-20060286311-A1 Composition for nonlinear optical material, optical element, nonlinear optical material, and process for producing the same FUJI PHOTO FILM CO., LTD. (JP) 2006-12-21 US disclosed