SCHEMBL2149585

SCHEMBL2149585

[O]c1ccc(-c2ccccc2)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.50
PTGS1 P23219 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
MAPT P10636 3/20 0.50
PTGS2 P35354 2/20 0.50
FABP2 P12104 1/20 0.50
TSHR P16473 1/20 0.50
AKR1C4 P17516 1/20 0.50
ADRA2B P18089 1/20 0.50
CHRM3 P20309 1/20 0.50
HTR2C P28335 1/20 0.50
DRD3 P35462 1/20 0.50
AKR1C3 P42330 1/20 0.50
AKR1C2 P52895 1/20 0.50
AKR1C1 Q04828 1/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
HPGD P15428 1/20 0.50

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
SCHEMBL14354414 0.79 BACE1 (0.44) LMNAMEN1KMT2AMAPTPTGS2
SCHEMBL19400433 0.79 MEN1 (0.50) LMNAPTGS1MEN1KMT2AMAPT
SCHEMBL15077185 0.77 PTGS1 (0.49) LMNAPTGS1MEN1KMT2AMAPT
SCHEMBL412228 0.77 MEN1 (0.49) LMNAPTGS1MEN1KMT2AMAPT
SCHEMBL28566500 0.77 PTGS1 (0.49) LMNAPTGS1MEN1KMT2AMAPT
SCHEMBL30216000 0.77 MEN1 (0.49) LMNAPTGS1MEN1KMT2AMAPT
SCHEMBL2140807 0.77 PTGS1 (0.49) LMNAPTGS1MEN1KMT2AMAPT
SCHEMBL5402168 0.76 BACE1 (0.50) LMNAPTGS1MEN1KMT2AMAPT
SCHEMBL19308531 0.76 FEN1 (0.50) LMNAPTGS1MEN1KMT2AMAPT
Sulfur Dioxide SCHEMBL28061237 0.75 MEN1 (0.47) LMNAPTGS1MEN1KMT2AMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1081228-B1 Process for producing carboxylic acid isomer SUMITOMO CHEMICAL CO (JP) 2011-07-13 EP disclosed
US-6365399-B1 EFFICIENT PROCESS FOR PRODUCTION OF CHEMICAL INTERMEDIATES OF DRUGS AND AGRICULTURAL CHEMICALS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-04-02 US disclosed
EP-1081228-A2 Process for producing carboxylic acid isomer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-03-07 EP disclosed