SCHEMBL9305510

SCHEMBL9305510

CCCCCCCCCCCCCC(=CC(=Cc1ccccc1)C=C(CCC(C)C)C(=O)O)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
LMNA P02545 1/20 0.49
APEX1 P27695 2/20 0.39
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
PTGES O14684 1/20 0.38
ALOX5 P09917 1/20 0.38
PPARG P37231 1/20 0.38
ASAH1 Q13510 2/20 0.38
ALDH1A1 P00352 1/20 0.38
ACER2 Q5QJU3 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
EGFR P00533 1/20 0.37
TUBB4A P04350 2/20 0.37
TUBB P07437 2/20 0.37
TUBA3C P0DPH7 2/20 0.37
TUBA1B P68363 2/20 0.37
TUBA4A P68366 2/20 0.37
TUBB4B P68371 2/20 0.37

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
SCHEMBL10685052 0.91 TDP1 (0.60) TDP1LMNAAPEX1CES2CES1
SCHEMBL5249714 0.86 LMNA (0.53) TDP1LMNAAPEX1CES2CES1
SCHEMBL8956285 0.82 LMNA (0.42) TDP1LMNAPTGESALOX5PPARG
SCHEMBL2042270 0.82 LMNA (0.49) TDP1LMNAAPEX1CES2CES1
SCHEMBL9785974 0.81 LMNA (0.48) TDP1LMNAAPEX1CES2CES1
SCHEMBL3082168 0.81 LMNA (0.48) TDP1LMNAAPEX1CES2CES1
SCHEMBL15402372 0.80 TDP1 (0.60) TDP1LMNAAPEX1CES2CES1
SCHEMBL3250732 0.80 TDP1 (0.67) TDP1LMNAAPEX1CES2CES1
SCHEMBL5467260 0.80 TDP1 (0.67) TDP1LMNAAPEX1CES2CES1
SCHEMBL489897 0.80 TDP1 (0.67) TDP1LMNAAPEX1CES2CES1

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-5302486-A Encapsulated toner process utilizing phase separation XEROX CORPORATION (US) 1994-04-12 US disclosed