SCHEMBL28397010

SCHEMBL28397010

CC(=CC(=O)Oc1ccc(F)cc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.49
KMT2A Q03164 4/20 0.44
ATM Q13315 1/20 0.44
LTB4R Q15722 4/20 0.44
LTB4R2 Q9NPC1 4/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
TTR P02766 1/20 0.41
PLA2G7 Q13093 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
DEGS1 O15121 1/20 0.41
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL28392269 0.83 NR4A1 (0.60) ELANEKMT2AMEN1MAPTTDP1
SCHEMBL28390998 0.82 DEGS1 (0.42) ELANEKMT2ALTB4RLTB4R2KDM4E
SCHEMBL28512933 0.82 KMT2A (0.45) ELANEKMT2AATMKDM4EALDH1A1
SCHEMBL28512923 0.82 KMT2A (0.45) ELANEKMT2AATMKDM4EALDH1A1
SCHEMBL13754641 0.79 SMN1; SMN2 (0.44) KMT2AATMKDM4EALDH1A1HPGD
SCHEMBL9660257 0.79 DEGS1 (0.47) ELANEKMT2ALTB4RLTB4R2ALDH1A1
SCHEMBL28888757 0.79 ALDH1A1 (0.53) KMT2AKDM4EALDH1A1MEN1GAA
SCHEMBL28393611 0.79 SMN1; SMN2 (0.45) KMT2AATMALDH1A1MEN1SMN1; SMN2
SCHEMBL18555000 0.78 DEGS1 (0.46) ELANEKMT2ALTB4RLTB4R2ALDH1A1
SCHEMBL13864068 0.76 SMN1; SMN2 (0.66) KMT2AATMKDM4EMEN1GAA

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
CN-111138396-A Method for synthesizing glutaconic anhydride compound by using carbon dioxide 大连理工大学 2020-05-12 CN disclosed