SCHEMBL30133804

SCHEMBL30133804

CC(F)(F)c1cc(F)ccc1Br

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 6/20 0.36
IDO1 P14902 2/20 0.35
NOTUM Q6P988 1/20 0.34
NR3C2 P08235 2/20 0.31
HTT P42858 2/20 0.31
EPHX1 P07099 1/20 0.31
EPAS1 Q99814 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL15974121 1.00 NR3C1 (0.36) NR3C1IDO1NOTUMNR3C2HTT
SCHEMBL29519382 0.87 NR3C1 (0.36) NR3C1IDO1NOTUMNR3C2HTT
SCHEMBL19693724 0.87 NR3C1 (0.36) NR3C1IDO1NOTUMNR3C2HTT
SCHEMBL278305 0.84 PTGS1 (0.39) NR3C1IDO1HTTMEN1MAPT
SCHEMBL15933087 0.83 NOTUM (0.36) NR3C1IDO1NOTUMNR3C2EPAS1
SCHEMBL624437 0.82 IDO1 (0.46) IDO1NOTUMHTTEPHX1MEN1
SCHEMBL29572164 0.82 IDO1 (0.46) IDO1NOTUMHTTEPHX1MEN1
SCHEMBL10322751 0.81 MEN1 (0.39) NR3C1NR3C2MEN1KMT2APTGS1
SCHEMBL29519425 0.81 MEN1 (0.39) NR3C1NR3C2MEN1KMT2APTGS1
SCHEMBL19926591 0.75 PKM (0.39) NR3C1HTTEPHX1MEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119119033-A Pyrazolopyridone compounds 百济神州有限公司 2024-12-13 CN disclosed
CN-118271284-A Estrogen receptor modulators and uses thereof 江苏威凯尔医药科技有限公司 2024-07-02 CN disclosed
EP-4380936-A1 PYRAZOLOPYRIDINONE COMPOUNDS BeiGene, Ltd. (KY) 2024-06-12 EP disclosed
CN-117836296-A Pyrazolopyridone compounds 百济神州有限公司 2024-04-05 CN disclosed
WO-2023011456-A1 PYRAZOLOPYRIDINONE COMPOUNDS BEIGENE, LTD. (KY) 2023-02-09 WO disclosed