SCHEMBL4104433

SCHEMBL4104433

C=CC(=O)N(CCCC)C(=O)C(=C)C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 3/20 0.41
ZDHHC2 Q9UIJ5 2/20 0.41
TSHR P16473 4/20 0.35
HPGD P15428 1/20 0.35
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA9 Q16790 2/20 0.33
FAAH O00519 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP8 P22894 1/20 0.32
EPHX2 P34913 1/20 0.30
ALDH1A1 P00352 2/20 0.30
THRA P10827 1/20 0.30
THRB P10828 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
SCHEMBL10664833 0.85 ZDHHC20 (0.47) ZDHHC20ZDHHC2TSHRHPGDCA12
SCHEMBL594654 0.84 USP2 (0.31) ZDHHC20ZDHHC2
SCHEMBL22923570 0.83 ZDHHC20 (0.44) ZDHHC20ZDHHC2TSHRHPGDCA12
SCHEMBL10660530 0.81 ALDH1A1 (0.35) ZDHHC20ZDHHC2TSHRALDH1A1
SCHEMBL8431639 0.79 CA12 (0.36) TSHRCA12CA1CA9MMP1
SCHEMBL8743186 0.79 ZDHHC20 (0.44) ZDHHC20ZDHHC2TSHRHPGDCA12
SCHEMBL14142921 0.78 ZDHHC20 (0.42) ZDHHC20ZDHHC2TSHRHPGDCA12
SCHEMBL8743344 0.78 ZDHHC20 (0.42) ZDHHC20ZDHHC2TSHRHPGDCA12
SCHEMBL25108824 0.77 ZDHHC20 (0.57) ZDHHC20ZDHHC2TSHRHPGDFAAH
SCHEMBL372729 0.77 ZDHHC20 (0.57) ZDHHC20ZDHHC2TSHRHPGDFAAH

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-20090214797-A1 INKJET INK COMPOSITION, AND INKJET RECORDING METHOD AND PRINTED MATERIAL EMPLOYING SAME FUJIFILM CORPORATION (JP) 2009-08-27 US disclosed
US-20080241485-A1 INK COMPOSITION AND IMAGE RECORDING METHOD AND IMAGE RECORDED MATTER USING SAME FUJIFILM CORPORATION (JP) 2008-10-02 US disclosed