SCHEMBL9550449

SCHEMBL9550449

Cc1c(-c2ccccc2)oc2c(CC(=O)O)cccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.56
STING1 Q86WV6 1/20 0.56
TDP1 Q9NUW8 1/20 0.47
PTGS1 P23219 1/20 0.44
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NR4A1 P22736 1/20 0.41
NR4A2 P43354 1/20 0.41
NR4A3 Q92570 1/20 0.41
KDM4E B2RXH2 3/20 0.41
AKR1B1 P15121 1/20 0.41
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
PTGS2 P35354 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CHRM2 P08172 1/20 0.40

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
SCHEMBL8875368 0.91 GLA (0.63) GLASTING1TDP1LMNASMN1; SMN2
SCHEMBL9550502 0.87 MMP2 (0.50) GLASTING1TDP1KDM4EALDH1A1
SCHEMBL9550380 0.85 STING1 (0.48) GLASTING1TDP1SMN1; SMN2MAPT
SCHEMBL12835532 0.81 ABCG2 (0.59) GLASTING1TDP1LMNASMN1; SMN2
SCHEMBL11705739 0.80 GLA (0.53) GLASTING1TDP1PTGS1SMN1; SMN2
SCHEMBL12835497 0.79 ABCG2 (0.60) GLASTING1TDP1GAAMAPT
SCHEMBL10550546 0.78 LMNA (0.51) GLALMNASMN1; SMN2GAAMAPT
SCHEMBL5118184 0.77 LMNA (0.54) GLASTING1TDP1LMNASMN1; SMN2
SCHEMBL14266220 0.75 LMNA (0.55) GLASTING1TDP1LMNASMN1; SMN2
SCHEMBL11549030 0.75 GLA (0.48) GLASTING1TDP1PTGS1SMN1; SMN2

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-5182295-A Miticides, fungicides ROUSSEL UCLAF (FR) 1993-01-26 US disclosed