SCHEMBL6829778

SCHEMBL6829778

CC(=O)Oc1cc([C]=O)cc([C]=O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
CYP19A1 P11511 1/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 3/20 0.43
CYP3A4 P08684 2/20 0.43
MEN1 O00255 1/20 0.43
TTR P02766 1/20 0.43
TP53 P04637 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
BACE1 P56817 2/20 0.42
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
POLB P06746 3/20 0.39
PKM P14618 1/20 0.39
ACHE P22303 2/20 0.39
ELANE P08246 2/20 0.38
HSD17B10 Q99714 1/20 0.37
GAA P10253 2/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL7282741 0.96 LMNA (0.47) LMNACYP19A1MAPTKDM4ECYP3A4
SCHEMBL14659690 0.81 CYP19A1 (0.46) LMNACYP19A1MAPTKDM4ECYP3A4
SCHEMBL21045001 0.81 CYP19A1 (0.42) LMNACYP19A1MAPTKDM4ECYP3A4
SCHEMBL7679108 0.80 LMNA (0.59) LMNAMAPTKDM4ECYP3A4MEN1
SCHEMBL489581 0.78 LMNA (0.59) LMNAMAPTKDM4ECYP3A4MEN1
SCHEMBL2010436 0.78 LMNA (0.59) LMNACYP19A1MAPTKDM4ECYP3A4
SCHEMBL16958037 0.77 LMNA (0.46) LMNACYP19A1MAPTKDM4ECYP3A4
SCHEMBL9019388 0.75 TOP1 (0.49) LMNAMAPTKDM4EMEN1TP53
SCHEMBL11196485 0.75 CA12 (0.51) LMNAMAPTKDM4ECYP3A4MEN1
SCHEMBL18371643 0.75 CYP19A1 (0.38) LMNACYP19A1MAPTKDM4ECYP3A4

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-6743889-B1 3,5-BIS(4-FLUOROBENZOYL)PHENOL WITH 4-FLUORO-4'-HYDROXY-BENZOPHENONE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2004-06-01 US disclosed