SCHEMBL10877752

SCHEMBL10877752

CCN(CCOc1ccc(Oc2cc(C)cc(C)c2)cc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSPO P30536 3/20 0.46
LTA4H P09960 4/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FFAR4 Q5NUL3 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
SCHEMBL10876432 0.88 TDP1 (0.53) LTA4HTRPM8ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL465562 0.86 LTA4H (0.59) LTA4HALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL10874997 0.85 MAPT (0.44) LTA4HALDH1A1NPC1LMNAALOX15
SCHEMBL10877393 0.83 LTA4H (0.56) LTA4HTRPM8SMN1; SMN2NPC1LMNA
SCHEMBL10878976 0.80 LTA4H (0.43) LTA4HALDH1A1SMN1; SMN2FFAR4
SCHEMBL10874866 0.80 FFAR4 (0.50) LTA4HALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL10878574 0.80 KDM4E (0.56) LTA4HALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL10878193 0.79 PPARA (0.45) LTA4HALDH1A1SMN1; SMN2NPC1FFAR4
SCHEMBL10879948 0.77 TDP1 (0.49) LTA4HTRPM8ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL10878256 0.77 LPAR1 (0.48) LTA4HALDH1A1SMN1; SMN2NPC1LMNA

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-4625048-A PESTICIDES HOFFMANN-LA ROCHE INC. (US) 1986-11-25 US disclosed