SCHEMBL4385698

SCHEMBL4385698

COc1ccc(-c2ccc3c(c2-c2ccc(OC)cc2)Cc2ccccc2-3)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.46
ABCB1 P08183 1/20 0.46
BCR P11274 1/20 0.46
HDAC4 P56524 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
MAPT P10636 6/20 0.43
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 2/20 0.43
BACE1 P56817 2/20 0.43
ACHE P22303 1/20 0.43
HIF1A Q16665 1/20 0.43
PGR P06401 1/20 0.41
HTR1A P08908 1/20 0.40
HTR7 P34969 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40

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
SCHEMBL21219216 0.87 MAPT (0.43) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL6828592 0.86 ABL1 (0.50) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL30207665 0.84 MEN1 (0.46) MAPTKDM4EALDH1A1HPGDBACE1
SCHEMBL28973245 0.84 MEN1 (0.46) MAPTKDM4EALDH1A1HPGDBACE1
SCHEMBL8984737 0.83 PGR (0.47) MAPTKDM4EALDH1A1HPGDPGR
SCHEMBL30150694 0.82 ADORA2A (0.45) MAPTKDM4EALDH1A1HPGDPGR
SCHEMBL29766669 0.82 ADORA2A (0.47) MAPTKDM4EALDH1A1HPGDPGR
SCHEMBL150217 0.82 ADORA2A (0.47) MAPTKDM4EALDH1A1HPGDPGR
Ammonia Solution, Strong SCHEMBL28343573 0.81 PGR (0.46) MAPTKDM4EALDH1A1HPGDPGR
SCHEMBL29558487 0.81 NCOA1 (0.44) MAPTKDM4EALDH1A1HPGDACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629429-B2 Aromatic resin; optical device; overcoating substrate with polymer; charge transfer compound, charge generating compoind CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2009-12-08 US disclosed
US-20040158017-A1 Substituted fluorene polymers their preparation and uses CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2004-08-12 US disclosed
EP-1385919-B1 SUBSTITUTED FLUORENE POLYMERS, THEIR PREPARATION AND USES CAMBRIDGE DISPLAY TECH LTD (GB) 2004-08-11 EP disclosed