SCHEMBL24901508

SCHEMBL24901508

OCC(F)Oc1ccc(Br)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.47
SLC6A4 P31645 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
MAPT P10636 4/20 0.37
POLB P06746 2/20 0.37
KDM4E B2RXH2 1/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
ALOX15 P16050 1/20 0.35
GFER P55789 1/20 0.35
ADAM17 P78536 1/20 0.35
LMNA P02545 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 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
SCHEMBL27841644 0.81 PPARG (0.42) SLC6A4PPARGPPARAMAPTLMNA
SCHEMBL21057198 0.76 LDHA (0.44) LDHASLC6A4PPARGPPARAMAPT
SCHEMBL27678840 0.76 SLC6A4 (0.44) LDHASLC6A4PPARGPPARAMAPT
SCHEMBL21057195 0.76 LDHA (0.44) LDHASLC6A4PPARGPPARAMAPT
SCHEMBL11749586 0.75 LDHA (0.47) LDHASLC6A4PPARGPPARAMAPT
SCHEMBL7830796 0.75 LDHA (0.47) LDHASLC6A4PPARGPPARAMAPT
SCHEMBL157708 0.75 ALOX15 (0.50) LDHASLC6A4PPARGPPARAMAPT
SCHEMBL7978503 0.72 LDHA (0.44) LDHASLC6A4PPARGPPARAMAPT
SCHEMBL7806642 0.72 LDHA (0.44) LDHASLC6A4PPARGPPARAMAPT
SCHEMBL7966339 0.72 LDHA (0.44) LDHASLC6A4PPARGPPARAMAPT

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
WO-2023286768-A1 HYDROGENATED QUINOXALINES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-01-19 WO disclosed