SCHEMBL8400922

SCHEMBL8400922

C=C(CC(=O)OC(=O)CCc1ccc(O)c(O)c1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 2/20 0.55
▸ IAPP P10997 3/20 0.50
▸ YWHAG P61981 1/20 0.44
▸ CYP19A1 P11511 1/20 0.44
▸ TYR P14679 1/20 0.44
▸ LCK P06239 1/20 0.44
▸ ERCC1 P07992 1/20 0.44
▸ ERCC4 Q92889 1/20 0.44
▸ CCR5 P51681 1/20 0.42
▸ MAPT P10636 4/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ BLM P54132 2/20 0.42
▸ HIF1A Q16665 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ PTGS1 P23219 1/20 0.42
▸ GAA P10253 3/20 0.41
▸ RGS12 O14924 1/20 0.41

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
SCHEMBL3383712 0.82 IAPP (0.57) APPIAPPCYP19A1TYRLCK
Dihydrocaffeic Acid SCHEMBL8400918 0.81 IAPP (0.50) APPIAPPCYP19A1TYRLCK
SCHEMBL3274537 0.76 APP (0.68) APPIAPPYWHAGCYP19A1TYR
Dopamine SCHEMBL31539510 0.74 KDM4E (0.62) IAPPLCKMAPTKDM4ELMNA
SCHEMBL28773631 0.72 MAPT (0.53) APPLCKERCC1ERCC4MAPT
SCHEMBL4965775 0.72 APP (0.68) APPIAPPYWHAGCYP19A1TYR
SCHEMBL28740259 0.72 IAPP (0.61) APPIAPPCYP19A1TYRLCK
Dihydrocaffeic Acid SCHEMBL7058919 0.71 IAPP (0.65) APPIAPPCYP19A1TYRLCK
Dihydrocaffeic Acid SCHEMBL29351390 0.71 IAPP (0.65) APPIAPPCYP19A1TYRLCK
Dihydrocaffeic Acid SCHEMBL245530 0.71 IAPP (0.65) APPIAPPCYP19A1TYRLCK

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-5981151-A IMAGE WISE EXPOSING TO ACTINIC LIGHT A PHOTOTHERMOGRAPHIC MATERIAL COMPRISING ON A SUPPORT A PHOTO-ADDRESSABLE THERMALLY DEVELOPABLE ELEMENT CONTAINING LIGHT-INSENSITIVE ORGANIC HEAVY METAL SALT, PHOTOSENSITIVE SILVER HALIDE AGFA-GEVAERT, N.V. (BE) 1999-11-09 — — US disclosed
Send feedback