SCHEMBL5459022

SCHEMBL5459022

Cc1ccc(C)c(C(CCCCCCCC(=O)O)C(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.49
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 2/20 0.40
ALDH1A1 P00352 2/20 0.40
PDE5A O76074 1/20 0.39
GSTK1 Q9Y2Q3 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
FFAR1 O14842 3/20 0.37
FFAR4 Q5NUL3 2/20 0.37
TBXA2R P21731 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 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
SCHEMBL5457626 1.00 TSHR (0.49) TSHRKMT2AMEN1GAAALDH1A1
SCHEMBL5457124 0.94 TSHR (0.51) TSHRKMT2AMEN1GAAPDE5A
SCHEMBL5156708 0.84 PDE5A (0.44) TSHRKMT2AMEN1GAAPDE5A
SCHEMBL20564477 0.82 CYSLTR2 (0.44) ALDH1A1GSTK1FFAR1FFAR4TBXA2R
SCHEMBL14360149 0.82 CYSLTR2 (0.44) ALDH1A1GSTK1FFAR1FFAR4TBXA2R
SCHEMBL7007322 0.82 CYSLTR2 (0.44) ALDH1A1GSTK1FFAR1FFAR4TBXA2R
SCHEMBL20563775 0.82 CYSLTR2 (0.44) ALDH1A1GSTK1FFAR1FFAR4TBXA2R
SCHEMBL20563923 0.81 CYSLTR2 (0.42) TSHRALDH1A1GSTK1TBXA2RHDAC3
SCHEMBL5156435 0.81 POLB (0.47) KMT2AMEN1
SCHEMBL6207758 0.80 SRC (0.42) TSHRKMT2AMEN1GAAPDE5A

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-20130143152-A1 CARRIER AND DEVELOPER FOR ELECTROSTATIC IMAGE DEVELOPMENT, AND IMAGE FORMATION METHOD AND APPARATUS FUJI XEROX CO., LTD. (JP) 2013-06-06 US disclosed
US-20070020552-A1 Carrier and developer for electrostatic image development, and image formation method and apparatus FUJI XEROX CO., LTD. (JP) 2007-01-25 US disclosed