SCHEMBL8716895

SCHEMBL8716895

C=Cc1cnc(-c2ccccn2)c(C=C)c1C=C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.42
LMNA P02545 3/20 0.42
CCR1 P32246 3/20 0.42
CCR5 P51681 3/20 0.42
CCR8 P51685 3/20 0.42
CYP1A2 P05177 1/20 0.42
POLB P06746 1/20 0.42
METAP1 P53582 1/20 0.42
BLM P54132 1/20 0.42
HIF1A Q16665 1/20 0.42
DOHH Q9BU89 1/20 0.42
P4HTM Q9NXG6 1/20 0.42
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
NPC1 O15118 3/20 0.38
TP53 P04637 3/20 0.37
ALOX15 P16050 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
HTT P42858 2/20 0.37

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
SCHEMBL8716904 0.98 KDM4E (0.41) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL8721461 0.95 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
SCHEMBL895711 0.83 LMNA (0.39) KDM4ELMNACCR1CCR5CCR8
SCHEMBL28619834 0.81 KDM4E (0.43) KDM4ELMNACCR1CCR5CCR8
SCHEMBL30965294 0.80 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
SCHEMBL29141638 0.80 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
SCHEMBL608226 0.75 KDM4E (0.48) KDM4ELMNACCR1CCR5CCR8
SCHEMBL4392033 0.74 KDM4E (0.39) KDM4ELMNACCR1CCR5CCR8
SCHEMBL8721465 0.74 KDM4E (0.46) KDM4ELMNACCR1CCR5CCR8
Phosphine SCHEMBL27992711 0.74 KDM4E (0.46) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9199201-B2 Self contained electroosmotic pump and method of making thereof GENERAL ELECTRIC COMPANY (US) 2015-12-01 US disclosed
EP-2791506-A1 IMPROVEMENTS IN AND RELATING TO ELECTROOSMOTIC PUMPS General Electric Company (US) 2014-10-22 EP disclosed
WO-2013087804-A1 IMPROVEMENTS IN AND RELATING TO ELECTROOSMOTIC PUMPS GENERAL ELECTRIC COMPANY (US) 2013-06-20 WO disclosed
US-20130156615-A1 SELF CONTAINED ELECTROOSMOTIC PUMP AND METHOD OF MAKING THEREOF GENERAL ELECTRIC COMPANY (US) 2013-06-20 US disclosed
US-5840443-A SECONDARY CELL COMPRISING ELECTROLYTE AND TWO ELECTRODES, AT LEAST ONE COMPRISING REDOX POLYMER MATERIAL WHICH CHANGES OXIDATION STATE TO TRANSFER CHARGE MIDWEST RESEARCH INSTITUTE (US) 1998-11-24 US disclosed