SCHEMBL3022337

SCHEMBL3022337

O=C(O)CCC1C2CC3CC(C2)CC1(CCC(=O)O)C3

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.39
EPHX2 P34913 5/20 0.36
HSD11B1 P28845 4/20 0.35
ALOX5 P09917 2/20 0.35
ALDH1A1 P00352 2/20 0.33
HSD11B2 P80365 1/20 0.31
HSD17B10 Q99714 1/20 0.30
EPHX1 P07099 1/20 0.30
THRB P10828 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL3816807 0.78 HSD11B1 (0.40) KDM4EHTTEPHX2HSD11B1ALOX5
SCHEMBL1862283 0.77 KDM4E (0.44) KDM4EHTTEPHX2HSD11B1ALOX5
SCHEMBL15890447 0.72
Acrylic Acid SCHEMBL11105628 0.71 THRB (0.33) THRBCYP2C9
SCHEMBL1323193 0.70 EPHX2 (0.48) KDM4EHTTEPHX2ALDH1A1
SCHEMBL6858927 0.70 EPHX2 (0.48) KDM4EHTTEPHX2ALDH1A1
SCHEMBL18979354 0.70 EPHX2 (0.36) HTTEPHX2
SCHEMBL18411712 0.69 HSD11B1 (0.46) KDM4EHTTEPHX2HSD11B1ALDH1A1
SCHEMBL26217994 0.69 ALDH1A1 (0.38) KDM4EHTTEPHX2HSD11B1ALDH1A1
SCHEMBL30477996 0.69 HSD11B1 (0.46) KDM4EHTTHSD11B1ALDH1A1

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-8309292-B2 Polyester resin for electrostatic image developing toner and manufacturing method of the same, electrostatic image developing toner, electrostatic image developer and image forming apparatus FUJI XEROX CO., LTD. (JP) 2012-11-13 US disclosed
US-20100196817-A1 POLYESTER RESIN FOR ELECTROSTATIC IMAGE DEVELOPING TONER AND MANUFACTURING METHOD OF THE SAME, ELECTROSTATIC IMAGE DEVELOPING TONER, ELECTROSTATIC IMAGE DEVELOPER AND IMAGE FORMING APPARATUS FUJI XEROX CO., LTD. (JP) 2010-08-05 US disclosed