SCHEMBL11079744

SCHEMBL11079744

Cc1ccc(C)c(COc2ccccc2O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 3/20 0.46
JAK2 O60674 1/20 0.46
LMNA P02545 1/20 0.46
APP P05067 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
TAAR1 Q96RJ0 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TACR1 P25103 1/20 0.43
CYP19A1 P11511 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL10867589 0.83 ALDH1A1 (0.54) GAAALDH1A1MAPTJAK2LMNA
SCHEMBL5644137 0.83 PTGDR2 (0.45) GAAMAPTLMNATAAR1L3MBTL1
SCHEMBL2557287 0.81 LIPE (0.55) GAAALDH1A1MAPTSMN1; SMN2TAAR1
SCHEMBL5838420 0.79 ALDH1A1 (0.57) ALDH1A1TP53PTGDR2KMT2A
SCHEMBL23680050 0.77 CDK4 (0.56) ALDH1A1SMN1; SMN2L3MBTL1CYP19A1TSHR
SCHEMBL27814043 0.75 SMN1; SMN2 (0.51) ALDH1A1MAPTLMNASMN1; SMN2L3MBTL1
SCHEMBL8592978 0.74 SMN1; SMN2 (0.54) GAAALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL9119121 0.74 LTA4H (0.53) ALDH1A1MAPTSMN1; SMN2TAAR1L3MBTL1
SCHEMBL7545101 0.73 MAPT (0.53) GAAALDH1A1MAPTJAK2LMNA
SCHEMBL5839223 0.73 FABP3 (0.58) ALDH1A1MAPTTP53

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
US-RE31624-E INHIBITORS OF PROSTAGLANDIN SYNTHESIS FORSYTH DENTAL INFIRMARY FOR CHILDREN (US) 1984-07-03 US claimed
US-4244956-A PROSTAGLANDIN SYNTHESIS INHIBITORS FORSYTH DENTAL INFIRMARY FOR CHILDREN (US) 1981-01-13 US claimed