SCHEMBL31296591

SCHEMBL31296591

CCCCCCCCCCCCCCCCCOC(=O)Cc1ccc(O)c(O)c1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
YWHAG P61981 1/20 0.66
TRPV1 Q8NER1 3/20 0.58
APP P05067 5/20 0.54
HSD17B10 Q99714 1/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL22471841 1.00 YWHAG (0.66) YWHAGTRPV1APPHSD17B10MEN1
SCHEMBL31296587 1.00 YWHAG (0.66) YWHAGTRPV1APPHSD17B10MEN1
SCHEMBL31296571 1.00 YWHAG (0.66) YWHAGTRPV1APPHSD17B10MEN1
SCHEMBL22471866 1.00 YWHAG (0.66) YWHAGTRPV1APPHSD17B10MEN1
SCHEMBL22471820 1.00 YWHAG (0.66) YWHAGTRPV1APPHSD17B10MEN1
SCHEMBL31296575 1.00 YWHAG (0.66) YWHAGTRPV1APPHSD17B10MEN1
SCHEMBL31296574 1.00 YWHAG (0.66) YWHAGTRPV1APPHSD17B10MEN1
SCHEMBL31296568 1.00 YWHAG (0.66) YWHAGTRPV1APPHSD17B10MEN1
SCHEMBL22471786 1.00 YWHAG (0.66) YWHAGTRPV1APPHSD17B10MEN1
SCHEMBL28655066 1.00 YWHAG (0.66) YWHAGTRPV1APPHSD17B10MEN1

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
CN-113767159-B Reversible thermochromic microcapsule pigment 百乐墨水株式会社 2024-12-06 CN disclosed