SCHEMBL25354343

SCHEMBL25354343

Fc1ccc(OC(F)(F)F)c(Oc2ccc(Br)cn2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
HSPB1 P04792 1/20 0.41
THRB P10828 1/20 0.39
EPHX2 P34913 1/20 0.38
POLB P06746 2/20 0.37
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.35
HPGD P15428 1/20 0.35
KDM4E B2RXH2 1/20 0.34
UGCG Q16739 1/20 0.34
ALPL P05186 1/20 0.34
HRH4 Q9H3N8 1/20 0.33
SLC22A12 Q96S37 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL428509 0.81 HSPB1 (0.59) L3MBTL1HSPB1POLBTSHRALDH1A1
SCHEMBL31498372 0.80 HSPB1 (0.43) L3MBTL1HSPB1POLBTSHRALDH1A1
SCHEMBL25356007 0.80 PTGS1 (0.45) L3MBTL1THRBEPHX2POLBTSHR
SCHEMBL22397221 0.75 THRB (0.41) L3MBTL1THRBEPHX2ALDH1A1MAPT
SCHEMBL29355127 0.75 THRB (0.41) L3MBTL1THRBEPHX2ALDH1A1MAPT
SCHEMBL4470732 0.73 THRB (0.51) L3MBTL1HSPB1THRBPOLBALDH1A1
SCHEMBL510244 0.71 KMT2A (0.66) L3MBTL1HSPB1POLBTSHRALDH1A1
SCHEMBL510359 0.71 KDM4E (0.64) L3MBTL1HSPB1THRBPOLBALDH1A1
SCHEMBL21330616 0.69 KMT2A (0.50) L3MBTL1HSPB1THRBPOLBTSHR
SCHEMBL510942 0.69 MAP4K4 (0.47) L3MBTL1HSPB1THRBPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023122778-A1 PYRIDAZINONE DERIVATIVES USEFUL AS T CELL ACTIVATORS GOSSAMER BIO SERVICES, INC. (US) 2023-06-29 WO disclosed
WO-2023122778-A1 PYRIDAZINONE DERIVATIVES USEFUL AS T CELL ACTIVATORS GOSSAMER BIO SERVICES, INC. (US) 2023-06-29 WO disclosed