SCHEMBL3260000

SCHEMBL3260000

CCOc1n[nH]c(C)c1Oc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.48
MEN1 O00255 8/20 0.48
MAPT P10636 6/20 0.48
ALOX12 P18054 4/20 0.48
KDM4E B2RXH2 3/20 0.48
TP53 P04637 3/20 0.48
NPSR1 Q6W5P4 3/20 0.48
MAPK1 P28482 2/20 0.48
USP2 O75604 2/20 0.48
XBP1 P17861 2/20 0.48
ALOX15 P16050 1/20 0.48
LTA4H P09960 2/20 0.47
LMNA P02545 4/20 0.47
GPR55 Q9Y2T6 3/20 0.47
HTT P42858 3/20 0.47
HIF1A Q16665 1/20 0.47
CNR1 P21554 2/20 0.46
LRRK2 Q5S007 1/20 0.44
ENPP3 O14638 1/20 0.43
ALPL P05186 1/20 0.43

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
SCHEMBL17156158 0.81 MAPT (0.46) KMT2AMEN1MAPTALOX12KDM4E
SCHEMBL3392191 0.81 MEN1 (0.45) KMT2AMEN1MAPTALOX12KDM4E
SCHEMBL17156161 0.80 DHODH (0.50) KMT2AMEN1MAPTALOX12KDM4E
SCHEMBL17156325 0.80 TTR (0.48) KMT2AMEN1MAPTALOX12KDM4E
SCHEMBL17156291 0.80 MAPT (0.44) KMT2AMEN1MAPTALOX12KDM4E
SCHEMBL17156341 0.79 MAPT (0.43) KMT2AMEN1MAPTALOX12KDM4E
SCHEMBL17156142 0.76 MRGPRX1 (0.42) KMT2AMEN1MAPTALOX12KDM4E
SCHEMBL17156183 0.75 CCR4 (0.41) KMT2AMEN1MAPTALOX12KDM4E
SCHEMBL3260006 0.74 CHEK1 (0.56) KMT2AMEN1MAPTALOX12KDM4E
SCHEMBL3263621 0.72 SLC5A1 (0.50) KMT2AMEN1MAPK1LMNAHTT

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-2929883-A1 Pyrazole derivatives as dihydroorotate dehydrogenase (DHODH) inhibitors INSTITUT PASTEUR (FR) 2015-10-14 EP disclosed
WO-2010015657-A2 NEW ALKOXYPYRAZOLES INSTITUT PASTEUR (FR) 2010-02-11 WO disclosed
WO-2010015657-A2 NEW ALKOXYPYRAZOLES INSTITUT PASTEUR (FR) 2010-02-11 WO disclosed
EP-2151433-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 EP disclosed
EP-2151433-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 EP disclosed