SCHEMBL7263341

SCHEMBL7263341

C=C(C)C(=O)OC1CC2CCC1(C)C2(C)C.CCOC(C)Oc1ccc(C=CC=Cc2ccc(O)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
MAPK1 P28482 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP2C19 P33261 1/20 0.43
ELANE P08246 2/20 0.43
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
XBP1 P17861 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP19A1 P11511 2/20 0.37
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL7264961 0.91 MAPT (0.45) MAPTMAPK1KMT2ACYP2C19ELANE
SCHEMBL5702438 0.89 CYP2C19 (0.48) MAPTMAPK1KMT2ACYP2C19ELANE
SCHEMBL6554440 0.89 CYP2C19 (0.44) MAPTMAPK1KMT2ACYP2C19ELANE
SCHEMBL7264890 0.87 KMT2A (0.44) MAPTMAPK1KMT2ACYP2C19ELANE
SCHEMBL6856597 0.83 CYP2C19 (0.57) MAPTMAPK1KMT2ACYP2C19ELANE
4-Vinylphenol SCHEMBL6555172 0.83 CYP2C19 (0.42) MAPTMAPK1KMT2ACYP2C19ELANE
4-Vinylphenol SCHEMBL6555163 0.83 MAPT (0.48) MAPTMAPK1KMT2ACYP2C19ELANE
SCHEMBL7269909 0.82 CYP2C19 (0.47) MAPTMAPK1KMT2ACYP2C19ELANE
SCHEMBL5702425 0.81 CYP2C19 (0.47) MAPTMAPK1KMT2ACYP2C19ELANE
SCHEMBL5702521 0.80 STAT3 (0.34) MAPK1CYP19A1ALDH1A1

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-6656660-B1 Resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-02 US disclosed
EP-1024406-A1 Resist composition WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 2000-08-02 EP disclosed