SCHEMBL9843567

SCHEMBL9843567

CC1(C)CC(C)(c2ccccc2O)c2c(O)cccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
ACHE P22303 1/20 0.35
OPRD1 P41143 3/20 0.34
OPRM1 P35372 1/20 0.34
OPRK1 P41145 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 3/20 0.32
POLB P06746 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ALDH1A1 P00352 2/20 0.32
EGFR P00533 2/20 0.32
CA2 P00918 2/20 0.32
LMNA P02545 2/20 0.32
FYN P06241 2/20 0.32
MMP9 P14780 2/20 0.32
ALOX15 P16050 2/20 0.32
RECQL P46063 2/20 0.32
HSD17B10 Q99714 2/20 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
SCHEMBL11156773 0.86 MEN1 (0.40) TP53CYP1A2ACHESMN1; SMN2ALDH1A1
SCHEMBL9843565 0.85 TP53 (0.36) TP53CYP1A2ACHEOPRD1OPRM1
SCHEMBL9638975 0.81 ESR1 (0.35) TP53CYP1A2ACHESMN1; SMN2ALDH1A1
SCHEMBL11161161 0.80 ACHE (0.41) TP53CYP1A2ACHEOPRD1OPRM1
SCHEMBL29740745 0.79 TP53 (0.39) TP53CYP1A2ACHEOPRD1OPRM1
SCHEMBL4455636 0.79 TP53 (0.39) TP53CYP1A2ACHEOPRD1OPRM1
SCHEMBL23084463 0.78 ALDH1A1 (0.43) TP53CYP1A2SMN1; SMN2ALDH1A1CA2
SCHEMBL11147187 0.78 OPRD1 (0.42) ACHEOPRD1OPRM1OPRK1ALDH1A1
SCHEMBL8652307 0.77 CYP1A2 (0.40) TP53CYP1A2ACHEHPGDL3MBTL1
SCHEMBL7105170 0.76 TRPA1 (0.41) TP53CYP1A2ACHEOPRD1OPRM1

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
EP-0445819-A2 Positive type photoresist composition FUJI PHOTO FILM CO., LTD. (JP) 1991-09-11 EP disclosed