SCHEMBL8664867

SCHEMBL8664867

O=C(OC(=O)c1nccc(F)c1C(=O)O)c1nccc(F)c1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.49
ASPH Q12797 2/20 0.49
KDM8 Q8N371 2/20 0.49
KMO O15229 7/20 0.36
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
BLM P54132 1/20 0.35
AGER Q15109 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NAPRT Q6XQN6 1/20 0.34
KDM4C Q9H3R0 3/20 0.33
KDM4A O75164 2/20 0.33
KDM5A P29375 2/20 0.33
KDM5B Q9UGL1 2/20 0.33
KDM6B O15054 2/20 0.33
KDM5C P41229 2/20 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
SCHEMBL10373429 0.85 KDM4E (0.60) KDM4EASPHKDM8KMOMAPT
SCHEMBL2114463 0.75 NAPRT (0.48) KDM4EASPHKDM8KMOMAPT
SCHEMBL644769 0.75 KDM4E (0.68) KDM4EASPHKDM8KMOMAPT
SCHEMBL3677764 0.75 KDM4E (0.38) KDM4EASPHKDM8MAPTALDH1A1
SCHEMBL10765922 0.73 KDM4E (0.46) KDM4EASPHKDM8KMOMAPT
SCHEMBL1478308 0.72 SMN1; SMN2 (0.46) KDM4EASPHKDM8KMOMAPT
SCHEMBL3426148 0.72 NAPRT (0.46) KDM4EASPHKDM8KMOMAPT
SCHEMBL21826438 0.72 KDM4E (0.44) KDM4EASPHKDM8KMOMAPT
SCHEMBL25068658 0.71 POLB (0.42) KDM4EASPHKDM8KMOALDH1A1
SCHEMBL310817 0.70 KDM4E (0.45) KDM4EASPHKDM8MAPTALDH1A1

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-5840904-A Fluoro-pyridine-2,3-dicarboxylic anhydrides which are intermediates for herbicidal pyridine-2,3-dicarboximides BASF AKTIENGESELLSCHAFT (DE) 1998-11-24 US disclosed