SCHEMBL7072157

SCHEMBL7072157

CC(=Cc1c(Br)ccc(Br)c1Br)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.48
APEX1 P27695 9/20 0.41
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
NR4A2 P43354 1/20 0.34
RXRG P48443 1/20 0.34
ERN1 O75460 2/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
TBXAS1 P24557 2/20 0.32

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
SCHEMBL7076985 0.87 AKR1C3 (0.44) AKR1C3APEX1RXRARXRBNR4A2
SCHEMBL7076351 0.82 AKR1C3 (0.55) AKR1C3APEX1RXRARXRBNR4A2
SCHEMBL3958047 0.78 AKR1C3 (0.47) AKR1C3APEX1RXRARXRBNR4A2
SCHEMBL3958052 0.78 AKR1C3 (0.47) AKR1C3APEX1RXRARXRBNR4A2
SCHEMBL124743 0.78 AKR1C3 (0.48) AKR1C3APEX1RXRARXRBNR4A2
SCHEMBL124742 0.78 AKR1C3 (0.48) AKR1C3APEX1RXRARXRBNR4A2
SCHEMBL14689452 0.74 EGFR (0.49) KMT2A
SCHEMBL122735 0.73 AKR1C3 (0.45) AKR1C3APEX1ERN1
SCHEMBL122734 0.73 AKR1C3 (0.45) AKR1C3APEX1ERN1
Methacrylic Acid SCHEMBL27633362 0.70 AKR1C3 (0.35) AKR1C3APEX1KMT2A

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-20030096172-A1 Hologram recording material composition and hologram recording medium DAISO CO., LTD. (JP) 2003-05-22 US disclosed