SCHEMBL8939660

SCHEMBL8939660

COC(=O)C(C)Oc1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.59
MAPT P10636 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.48
POLB P06746 1/20 0.48
LMNA P02545 1/20 0.48
FPR2 P25090 2/20 0.45
SCN9A Q15858 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALDH2 P05091 1/20 0.45
TP53 P04637 1/20 0.44
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
TAS1R2 Q8TE23 1/20 0.44
GAA P10253 1/20 0.43

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
SCHEMBL5108544 0.95 ALDH1A1 (0.65) ALDH1A1MAPTMEN1KMT2AL3MBTL1
SCHEMBL4250581 0.86 KMT2A (0.58) ALDH1A1MAPTMEN1KMT2AL3MBTL1
SCHEMBL10563731 0.84 POLB (0.53) ALDH1A1MAPTMEN1KMT2AL3MBTL1
SCHEMBL10879122 0.84 LMNA (0.56) ALDH1A1MAPTMEN1KMT2AL3MBTL1
SCHEMBL9320809 0.83 MEN1 (0.62) MAPTMEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL10949396 0.83 KMT2A (0.55) ALDH1A1MAPTMEN1KMT2AL3MBTL1
SCHEMBL9633386 0.83 ALDH1A1 (0.58) ALDH1A1MAPTSMN1; SMN2POLBLMNA
SCHEMBL11154253 0.83 CYP1A2 (0.59) ALDH1A1MAPTKMT2ASMN1; SMN2POLB
SCHEMBL158783 0.83 MEN1 (0.51) MAPTMEN1KMT2AL3MBTL1LMNA
SCHEMBL11511740 0.82 LMNA (0.58) ALDH1A1L3MBTL1LMNA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5489387-A Separation agent comprising acyl- or carbamoyl-substituted polysaccharide DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-06 US disclosed
US-5415780-A Separation agent comprising acyl- or carbamoyl-substituted polysaccharide DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1995-05-16 US disclosed
US-5229002-A Separation of optical isomers, cellulose esterified with phenylazobenzoic acid DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1993-07-20 US disclosed
US-5137638-A Mixture of orticla isomers; cellulose tricinnamate DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1992-08-11 US disclosed
US-5075009-A Optical resolution of racemic mixtures using a cellulose tris-4-biphenyl carboxylate DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1991-12-24 US disclosed
US-5017290-A Chromatography DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1991-05-21 US disclosed
US-4966694-A CELLULOSE TRI-BETA-NAPHTHOATE; OPTICAL RESOLUTIONS DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1990-10-30 US disclosed
US-4879038-A Separation agent comprising acyl- or carbamoyl-substituted polysaccharide DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1989-11-07 US disclosed