SCHEMBL9703417

SCHEMBL9703417

C=CCOS(=O)(=O)c1ccc(C)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 1/20 0.43
CNR2 P34972 1/20 0.41
VDR P11473 1/20 0.39
CYP24A1 Q07973 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
STAT3 P40763 1/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
CA12 O43570 2/20 0.37
CA9 Q16790 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
GAA P10253 1/20 0.37
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL169846 0.88 C5AR1 (0.44) C5AR1CNR2VDRHTTSMN1; SMN2
Ammonia Solution, Strong SCHEMBL12478377 0.86 C5AR1 (0.43) C5AR1CNR2VDRHTTSMN1; SMN2
SCHEMBL28664754 0.86 C5AR1 (0.43) C5AR1CNR2VDRHTTSMN1; SMN2
SCHEMBL11282649 0.86 CNR2 (0.47) C5AR1CNR2VDRHTTSMN1; SMN2
Benzoic Acid SCHEMBL4778409 0.83 STAT3 (0.54) C5AR1SMN1; SMN2STAT3ALDH1A1LMNA
Trimethylammonium SCHEMBL4908728 0.83 C5AR1 (0.44) C5AR1CNR2VDRHTTSMN1; SMN2
Alcohol SCHEMBL11289368 0.82 NPSR1 (0.42) C5AR1VDRSMN1; SMN2STAT3ALDH1A1
SCHEMBL14780436 0.82 C5AR1 (0.40) C5AR1CNR2VDRHTTSMN1; SMN2
Alcohol SCHEMBL11280156 0.81 CNR2 (0.43) C5AR1CNR2VDRHTTSTAT3
SCHEMBL62040 0.81 PARL (0.43) SMN1; SMN2ALDH1A1MAPK1CA12CA9

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
US-5147747-A Low fusing temperature tone powder of crosslinked crystalline and amorphous polyesters EASTMAN KODAK COMPANY (US) 1992-09-15 US disclosed