SCHEMBL30455590

SCHEMBL30455590

Cc1ccc(OC(F)F)c(Oc2ccc(Br)cn2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
GAA P10253 1/20 0.38
ALDH1A1 P00352 3/20 0.36
RXRA P19793 2/20 0.36
GRIN1 Q05586 2/20 0.36
GRIN2B Q13224 2/20 0.36
SCN9A Q15858 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 3/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
MAPT P10636 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL25355182 1.00 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL30454375 0.95 GAA (0.38) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL25355935 0.95 GAA (0.38) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL25355273 0.83 ACHE (0.50) ALDH1A1L3MBTL1KMT2ALMNAPOLB
SCHEMBL30454767 0.83 ACHE (0.50) ALDH1A1L3MBTL1KMT2ALMNAPOLB
SCHEMBL17050816 0.81 L3MBTL1 (0.42) ALDH1A1L3MBTL1KMT2ALMNAPOLB
SCHEMBL25353410 0.79 TRPA1 (0.37) GAAALDH1A1L3MBTL1KMT2ALMNA
SCHEMBL25355051 0.77 ALOX15 (0.39) GAAALDH1A1KMT2APOLBMAPT
SCHEMBL738390 0.74 DAO (0.39) ALDH1A1RXRAGRIN1GRIN2BTHRB
SCHEMBL29482231 0.74 DAO (0.39) ALDH1A1RXRAGRIN1GRIN2BTHRB

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