SCHEMBL8552848

SCHEMBL8552848

CN1OC1(C(=O)Oc1ccc(OCc2nccc(-c3ccccc3)n2)cc1)c1ccc(OCc2nccc(-c3ccccc3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 1/20 0.36
DUSP10 Q9Y6W6 1/20 0.36
FFAR1 O14842 3/20 0.35
KMT2A Q03164 3/20 0.35
KDM4E B2RXH2 3/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ENPP3 O14638 1/20 0.34
ENPP1 P22413 1/20 0.34
PORCN Q9H237 1/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL8560309 0.85 KCNH2 (0.39) FFAR1KDM4EMAPTENPP3ENPP1
SCHEMBL8559969 0.81 PPARD (0.49) KDM4EMAPTMEN1L3MBTL1NPC1
SCHEMBL8835183 0.78 PARP10 (0.50) KDM4ENPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL8557960 0.78 GRM5 (0.41) SMPD1KMT2AKDM4EMAPTMEN1
SCHEMBL8557729 0.77 PDE10A (0.43) FFAR1KMT2AKDM4EMAPTNPC1
SCHEMBL8834199 0.76 GPBAR1 (0.55) FFAR1
SCHEMBL8559981 0.76 PARP10 (0.39) FFAR1KMT2AKDM4EMEN1NPC1
SCHEMBL8559028 0.76 PDE10A (0.45) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL8557961 0.74 MAPT (0.42) KMT2AKDM4EMAPTMEN1L3MBTL1
SCHEMBL8557149 0.71 KMT2A (0.38) SMPD1DUSP10KMT2AKDM4EMAPT

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-5714488-A FOR TREATMENT OF ALLERGIC AND INFLAMMATORY DISEASE STATES ABBOTT LABORATORIES (US) 1998-02-03 US disclosed