SCHEMBL15436293

SCHEMBL15436293

S=c1cc[nH]c(-c2ccccn2)c1-c1ccccn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.48
LMNA P02545 3/20 0.48
CCR1 P32246 3/20 0.48
CCR5 P51681 3/20 0.48
CCR8 P51685 3/20 0.48
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
METAP1 P53582 1/20 0.48
BLM P54132 1/20 0.48
HIF1A Q16665 1/20 0.48
DOHH Q9BU89 1/20 0.48
P4HTM Q9NXG6 1/20 0.48
PSMD14 O00487 1/20 0.46
PRKCI P41743 1/20 0.45
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
TP53 P04637 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALOX15 P16050 2/20 0.42
HTT P42858 2/20 0.42

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
SCHEMBL404747 0.76 PRKCI (0.56) KDM4ELMNACCR1CCR5CCR8
SCHEMBL5163461 0.74 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL28264205 0.74 PRKCI (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL11502579 0.74 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL409061 0.73 CCR1 (0.48) KDM4ELMNACCR1CCR5CCR8
SCHEMBL11910164 0.71 KDM4E (0.81) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL29907716 0.68 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL29351528 0.68 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL3711450 0.68 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL5922 0.68 KDM4E (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2091077-B1 ELECTRODE COATING MATERIAL, ELECTRODE STRUCTURE AND SEMICONDUCTOR DEVICE SONY CORP (JP) 2014-01-29 EP disclosed