SCHEMBL3326703

SCHEMBL3326703

CCc1ccc(OC(C)OCCOc2ccccc2-c2cccc(OC)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.46
CASR P41180 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
MAPK1 P28482 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
RECQL P46063 1/20 0.40
CYP1A1 P04798 1/20 0.39
CYP2E1 P05181 1/20 0.39
CYP2C8 P10632 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2A6 P11509 1/20 0.39
CYP4B1 P13584 1/20 0.39

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
SCHEMBL3321951 0.88 ADRB2 (0.46) MAPK1LMNAMEN1KMT2ATP53
SCHEMBL2758497 0.88 NPSR1 (0.44) NPSR1CASRL3MBTL1MAPK1LMNA
SCHEMBL3323839 0.81 LTA4H (0.41) NPSR1L3MBTL1MAPK1LMNAFFAR1
SCHEMBL14113260 0.78 PPARA (0.39) LMNA
SCHEMBL3322916 0.78 DRD2 (0.39) NPSR1L3MBTL1MEN1KMT2ACYP1A2
SCHEMBL3304672 0.77 FFAR1 (0.38) L3MBTL1TDP1FFAR1NPC1MAPT
SCHEMBL682270 0.77 AKR1C3 (0.39) NPSR1CASRMAPK1MEN1KMT2A
SCHEMBL3299018 0.76 HTR1B (0.48)
SCHEMBL3297979 0.76 GPR84 (0.43) NPSR1L3MBTL1TP53MAPT
SCHEMBL3323842 0.75 CHRNB2 (0.44) L3MBTL1MAPK1LMNACYP1A2CYP2C9

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
US-20120003585-A1 ACTINIC-RAY- OR RADIATION-SENSITIVE RESIN COMPOSITION AND METHOD OF FORMING PATTERN USING THE COMPOSITION FUJIFILM CORPORATION (JP) 2012-01-05 US disclosed