SCHEMBL24901696

SCHEMBL24901696

OCC(F)(F)Oc1ccc(Br)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.43
KMT2A Q03164 3/20 0.41
TSHR P16473 2/20 0.41
MEN1 O00255 2/20 0.41
SMN1; SMN2 Q16637 6/20 0.39
LMNA P02545 5/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
HPGD P15428 4/20 0.39
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 3/20 0.39
TP53 P04637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PKM P14618 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 2/20 0.36
PTGDR2 Q9Y5Y4 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
SCHEMBL24901470 0.81 USP28 (0.38) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL2414604 0.80 SLC1A5 (0.43) RECQLKMT2ATSHRMEN1ALDH1A1
SCHEMBL6601275 0.80 KMT2A (0.40) RECQLKMT2ATSHRMEN1SMN1; SMN2
SCHEMBL29855159 0.80 SLC1A5 (0.43) RECQLKMT2ATSHRMEN1ALDH1A1
SCHEMBL23272217 0.80 KMT2A (0.44) RECQLKMT2ATSHRMEN1SMN1; SMN2
SCHEMBL24901452 0.80 ALDH1A1 (0.43) KMT2ATSHRMEN1SMN1; SMN2LMNA
SCHEMBL24901454 0.79 KDM4E (0.40) RECQLKMT2ATSHRMEN1SMN1; SMN2
SCHEMBL31085195 0.78 USP28 (0.38) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL25875508 0.75 TSHR (0.39) RECQLKMT2ATSHRMEN1SMN1; SMN2
SCHEMBL13020197 0.74 TSHR (0.44) RECQLKMT2ATSHRMEN1SMN1; SMN2

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