SCHEMBL5835571

SCHEMBL5835571

O=C(OSSOC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.61
F2 P00734 1/20 0.61
TSHR P16473 5/20 0.56
TDP1 Q9NUW8 4/20 0.50
TP53 P04637 1/20 0.50
ALDH1A1 P00352 5/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 3/20 0.48
POLB P06746 2/20 0.48
MAPK1 P28482 1/20 0.48
HIF1A Q16665 1/20 0.48
SLC6A2 P23975 1/20 0.48
SLC6A3 Q01959 1/20 0.48
CES2 O00748 2/20 0.48
CES1 P23141 2/20 0.48
DAO P14920 1/20 0.48
NAPRT Q6XQN6 1/20 0.48
HSD17B10 Q99714 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PKM P14618 1/20 0.46

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
SCHEMBL9679649 0.85 LMNA (0.61) LMNAF2TSHRTDP1TP53
SCHEMBL28123625 0.82 ALDH1A1 (0.47) LMNAF2TSHRTDP1TP53
SCHEMBL4072679 0.81 TSHR (0.58) LMNAF2TSHRTDP1TP53
SCHEMBL27388295 0.81 LMNA (0.56) LMNAF2TSHRTDP1TP53
SCHEMBL27811187 0.81 LMNA (0.56) LMNAF2TSHRTDP1TP53
SCHEMBL3062362 0.79 LMNA (0.54) LMNAF2TSHRTDP1TP53
SCHEMBL28202295 0.79 TSHR (0.56) LMNAF2TSHRTDP1TP53
Benzoyl Peroxide SCHEMBL4745654 0.79 LMNA (0.94) LMNAF2TSHRTDP1TP53
SCHEMBL28133247 0.77 LMNA (0.64) LMNAF2TSHRTDP1TP53
SCHEMBL25171189 0.76 LMNA (0.50) LMNAF2TSHRTDP1TP53

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-7049373-B2 Process for preparation of graft polymers CARNEGIE MELLON UNIVERSITY (US) 2006-05-23 US disclosed
US-20020183473-A1 Process for preparation of graft polymers CARNEGIE MELLON UNIVERSITY 2002-12-05 US disclosed