SCHEMBL4612865

SCHEMBL4612865

Ic1cnc(-c2ccccn2)c(-c2ccccn2)c1I

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.46
LMNA P02545 3/20 0.46
CCR1 P32246 3/20 0.46
CCR5 P51681 3/20 0.46
CCR8 P51685 3/20 0.46
CYP1A2 P05177 1/20 0.46
POLB P06746 1/20 0.46
METAP1 P53582 1/20 0.46
BLM P54132 1/20 0.46
HIF1A Q16665 1/20 0.46
DOHH Q9BU89 1/20 0.46
P4HTM Q9NXG6 1/20 0.46
NPC1 O15118 5/20 0.41
RAB9A P51151 4/20 0.41
TP53 P04637 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALOX15 P16050 2/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41

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
SCHEMBL4613441 0.77 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL4612879 0.74 KDM4E (0.46) KDM4ELMNACCR1CCR5CCR8
SCHEMBL5595484 0.73 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL4614805 0.73 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL4614666 0.72 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL5322720 0.71 KDM4E (0.59) KDM4ELMNACCR1CCR5CCR8
SCHEMBL3466392 0.70 KDM4E (0.46) KDM4ELMNACCR1CCR5CCR8
SCHEMBL11910164 0.70 KDM4E (0.81) KDM4ELMNACCR1CCR5CCR8
SCHEMBL22761528 0.68 KDM4E (0.55) KDM4ELMNACCR1CCR5CCR8
SCHEMBL323086 0.68 KDM4E (0.68) KDM4ELMNACCR1CCR5CCR8

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
EP-1520846-B1 Method for producing polymerized hydrocarbon JFE CHEMICAL CORP (JP) 2008-03-05 EP disclosed
US-7138484-B2 Method for producing polymerized hydrocarbon JFE CHEMICAL CORPORATION (JP) 2006-11-21 US disclosed
US-20050075478-A1 Method for producing polymerized hydrocarbon JFE CHEMICAL CORPORATION (JP) 2005-04-07 US disclosed
EP-1520846-A1 Method for producing polymerized hydrocarbon JFE Chemical Corporation (JP) 2005-04-06 EP disclosed