SCHEMBL9853446

SCHEMBL9853446

Cc1cc(N)ccc1OCC(C)(c1ccccc1)c1ccccc1.O=C1C=CC(=O)N1.O=C1C=CC(=O)N1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.34
KDM4E B2RXH2 3/20 0.33
TSHR P16473 2/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
VDR P11473 3/20 0.32
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
BRD4 O60885 2/20 0.31
PPARG P37231 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
SCN4A P35499 1/20 0.31

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
SCHEMBL9853450 0.89 KDM4E (0.37) MCHR1KDM4ETSHRMRGPRX4PTGDR2
SCHEMBL9853442 0.79 MAPT (0.37) KDM4EL3MBTL1TDP1PPARGPPARD
SCHEMBL9853447 0.73 BACE1 (0.35) KDM4ETSHRMAPK1L3MBTL1LMNA
SCHEMBL8175332 0.71 ALDH1A1 (0.43) KDM4ETSHRMAPK1L3MBTL1HDAC3
SCHEMBL9853454 0.70 MAPT (0.39) KDM4EHPGDPTGDR2LMNACYP1A2
SCHEMBL942491 0.69 VDR (0.51) MCHR1HDAC3HDAC6VDRALDH1A1
SCHEMBL20496732 0.68 ALDH1A1 (0.53) KDM4ETSHRMAPK1L3MBTL1LMNA
SCHEMBL9853451 0.68 SRC (0.41) MAPK1CYP1A2BRD4MEN1TP53
SCHEMBL9654477 0.67 MAOB (0.50) TSHRHPGDMAPK1L3MBTL1TDP1
SCHEMBL2565945 0.67 ALDH1A1 (0.52) MCHR1KDM4ETSHRL3MBTL1LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0446718-A2 Phenoxy bis-maleimides and process for their preparation Bromine Compounds Ltd. (IL) 1991-09-18 EP claimed
EP-0446718-A2 Phenoxy bis-maleimides and process for their preparation Bromine Compounds Ltd. (IL) 1991-09-18 EP disclosed