SCHEMBL7964764

SCHEMBL7964764

C=C(CC1(C)CCC1)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 4/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
FFAR3 O14843 1/20 0.32
TET3 O43151 1/20 0.31
TET1 Q8NFU7 1/20 0.31
CYP2C19 P33261 2/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
GRIK1 P39086 1/20 0.30
GRIK2 Q13002 1/20 0.30
GRM1 Q13255 1/20 0.30
GRM2 Q14416 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL5897821 0.96 CYP2C19 (0.34) TET2SMN1; SMN2FFAR3TET3TET1
SCHEMBL1334944 0.94 CYP2C19 (0.38) TET2SMN1; SMN2FFAR3TET3TET1
SCHEMBL7978219 0.94 CYP2C19 (0.38) TET2SMN1; SMN2FFAR3TET3TET1
SCHEMBL7976321 0.94 CYP2C19 (0.38) TET2SMN1; SMN2FFAR3TET3TET1
SCHEMBL726325 0.77 EPHX1 (0.43) TET2TET3TET1
SCHEMBL5534731 0.77
SCHEMBL2791027 0.76 SMN1; SMN2 (0.33) SMN1; SMN2POLBCYP2C19
SCHEMBL2791179 0.75 CYP2C19 (0.33) SMN1; SMN2POLBCYP2C19TSHR
SCHEMBL11385759 0.74 FFAR3 (0.33) FFAR3CYP2C19TSHRNFKB1
Methyl Alcohol SCHEMBL30448702 0.72 ALDH1A1 (0.44) TET2SMN1; SMN2CYP2C19TSHR

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-6280897-B1 GENERATION OF ACID WITH ACTINIC RADIATION KABUSHIKI KAISHA TOSHIBA (JP) 2001-08-28 US disclosed