SCHEMBL24901459

SCHEMBL24901459

Cc1cc(OC(F)(F)CO)ccc1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
MAPK1 P28482 2/20 0.38
LMNA P02545 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
STAT3 P40763 1/20 0.38
HAO1 Q9UJM8 1/20 0.38
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
MAPT P10636 3/20 0.37
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CHRNA3 P32297 1/20 0.35
ALDH1A1 P00352 2/20 0.35
FBP1 P09467 1/20 0.34
PTPN1 P18031 1/20 0.33
HBB P68871 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
SCHEMBL2038046 0.85 SMN1; SMN2 (0.39) SMN1; SMN2MAPK1LMNAALOX15TSHR
SCHEMBL29427162 0.80 GPR3 (0.45) SMN1; SMN2LMNAALOX15HAO1RAB9A
SCHEMBL1221631 0.80 GPR3 (0.45) SMN1; SMN2LMNAALOX15HAO1RAB9A
SCHEMBL25875499 0.76 HAO1 (0.40) SMN1; SMN2MAPK1LMNAALOX15TSHR
SCHEMBL24901455 0.75 HAO1 (0.35) SMN1; SMN2MAPK1LMNAALOX15TSHR
SCHEMBL30752460 0.74 HAO1 (0.44) SMN1; SMN2MAPK1LMNAALOX15TSHR
SCHEMBL17442053 0.74 POLB (0.35) MAPK1LMNAKMT2AMEN1RAB9A
SCHEMBL24901458 0.74 FBP1 (0.46) SMN1; SMN2MAPK1LMNAALOX15TSHR
SCHEMBL29972693 0.72 SMN1; SMN2 (0.47) SMN1; SMN2MAPK1LMNAALOX15TSHR
SCHEMBL2038048 0.72 SMN1; SMN2 (0.47) SMN1; SMN2MAPK1LMNAALOX15TSHR

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