SCHEMBL25354281

SCHEMBL25354281

NNc1ccc(S(=O)(=O)N2CCC(F)(F)C2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIP4K2A P48426 1/20 0.53
NAMPT P43490 4/20 0.44
F13A1 P00488 1/20 0.44
TGM2 P21980 1/20 0.44
TGM1 P22735 1/20 0.44
USP2 O75604 4/20 0.43
CYP1A2 P05177 3/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
MAPT P10636 2/20 0.42

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
SCHEMBL25356264 0.83 PKM (0.50) PIP4K2ANAMPTUSP2TSHRKDM4E
SCHEMBL12169332 0.80 PKM (0.57) TSHRGAAALDH1A1SMN1; SMN2CYP2C19
SCHEMBL17394167 0.80 PIP4K2A (0.47) PIP4K2ANAMPTUSP2TSHRKDM4E
SCHEMBL14132264 0.78 POLB (0.62) PIP4K2ATSHRGAAALDH1A1SMN1; SMN2
SCHEMBL25359305 0.77 ALDH1A1 (0.51) PIP4K2AALDH1A1SMN1; SMN2
SCHEMBL6945990 0.74 USP2 (0.71) USP2ALOX15MAPTGAAKDM4E
SCHEMBL21514947 0.73 POLB (0.50) PIP4K2ANAMPTTSHRMAPTKDM4E
SCHEMBL6951550 0.73 GAA (0.69) MAPTGAAALDH1A1SMN1; SMN2POLB
SCHEMBL6944909 0.72 ATM (0.63) USP2TSHRALDH1A1SMN1; SMN2POLB
SCHEMBL24058307 0.71 POLB (0.61) PIP4K2ANAMPTGAAPIK3C3KDM4E

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