SCHEMBL11845488

SCHEMBL11845488

CC(C)C1(O)C(=O)C=Cc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
PKM P14618 2/20 0.38
PDK2 Q15119 1/20 0.38
P2RX4 Q99571 4/20 0.34
P2RX1 P51575 1/20 0.34
P2RX3 P56373 1/20 0.34
P2RX7 Q99572 1/20 0.34
KIF11 P52732 5/20 0.34
ALDH1A1 P00352 4/20 0.33
POLB P06746 2/20 0.33
MAPT P10636 2/20 0.33
THRB P10828 2/20 0.33
RECQL P46063 2/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
BCHE P06276 1/20 0.33
PTPRC P08575 1/20 0.33
IDO1 P14902 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL8461309 0.76 KDM4E (0.41) KDM4EPKMPDK2P2RX4KIF11
SCHEMBL14293791 0.75 KDM4E (0.40) KDM4EPKMKIF11ALDH1A1POLB
SCHEMBL11852375 0.71 KDM4E (0.49) KDM4EPKMP2RX4P2RX1P2RX3
SCHEMBL4235643 0.71 PDK2 (0.41) KDM4EPKMPDK2KIF11ALDH1A1
SCHEMBL6164444 0.71 S100A4 (0.41) KDM4EPKMKIF11ALDH1A1POLB
SCHEMBL3895348 0.69 THRB (0.50) KDM4EPKMP2RX4KIF11ALDH1A1
SCHEMBL11838929 0.69 KDM4E (0.50) KDM4EPKMP2RX4P2RX1P2RX3
SCHEMBL11846907 0.68 KDM4E (0.45) KDM4EPKMP2RX4KIF11ALDH1A1
SCHEMBL6516819 0.68 ALDH1A1 (0.36) KDM4EPKMP2RX4KIF11ALDH1A1
SCHEMBL11816295 0.68 KDM4E (0.35) KDM4EPKMKIF11

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-3985566-A Photosensitive crosslinkable 1-carbonyloxy-1H-naphthalene-2-one polymers and process for their preparation HOECHST AKTIENGESELLSCHAFT (DT) 1976-10-12 US disclosed