SCHEMBL9131237

SCHEMBL9131237

C=C(C)C(=O)OC(C)(C)C.C=Cc1ccc2ccccc2c1.C=Cc1ccccc1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.35
APP P05067 1/20 0.35
PTGS1 P23219 1/20 0.35
MAOB P27338 1/20 0.34
PPARA Q07869 1/20 0.34
CNR2 P34972 1/20 0.33
LMNA P02545 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
ABL1 P00519 1/20 0.32
ABCB1 P08183 1/20 0.32
BCR P11274 1/20 0.32
TRPA1 O75762 1/20 0.32
MEN1 O00255 1/20 0.32
EGFR P00533 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL6858822 0.87 MAPT (0.41) MAPTMAOBLMNAKDM4EALDH1A1
Styrene SCHEMBL4143998 0.86 MAPT (0.37) MAPTLMNAKDM4EALDH1A1ABL1
SCHEMBL6371474 0.85 MAPT (0.33) MAPTMAOBPPARALMNAABL1
SCHEMBL14815600 0.83 MAPT (0.33) MAPTMAOBLMNAKDM4EALDH1A1
Styrene SCHEMBL3400648 0.75 ALDH1A1 (0.45) MAPTKDM4EALDH1A1GAAMEN1
4-Vinylphenol SCHEMBL7711593 0.74 MIF (0.42) MAPTMAOBKDM4EALDH1A1MEN1
4-Vinylphenol SCHEMBL7711559 0.74 MIF (0.42) MAPTMAOBKDM4EALDH1A1MEN1
SCHEMBL6037016 0.74 ELANE (0.48) MAPTMAOBLMNAKDM4EALDH1A1
SCHEMBL16660449 0.74 ELANE (0.48) MAPTAPPPTGS1KDM4EALDH1A1
Indene SCHEMBL6834259 0.74 CYP2D6 (0.36) MAPTLMNAKDM4EMAPK1TDP1

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-5443690-A Pattern formation material and pattern formation method FUJITSU LIMITED (JP) 1995-08-22 US disclosed