SCHEMBL8044272

SCHEMBL8044272

C=CCC(=O)O.CCCCOC(=O)/C=C\C(=O)OCCCC

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.69
HCAR2 Q8TDS4 5/20 0.66
TSHR P16473 4/20 0.59
HPGD P15428 1/20 0.59
MAPT P10636 1/20 0.53
RAB9A P51151 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
ALDH1A1 P00352 2/20 0.42
APP P05067 5/20 0.42
CYP3A4 P08684 1/20 0.41
PRKCA P17252 1/20 0.37

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
SCHEMBL8044274 1.00 ATM (0.69) ATMHCAR2TSHRHPGDMAPT
Butyl Fumarate SCHEMBL27481840 0.95 HCAR2 (0.75) ATMHCAR2TSHRHPGDMAPT
SCHEMBL7634294 0.90 TSHR (0.76) ATMHCAR2TSHRHPGDMAPT
SCHEMBL27977353 0.89 HCAR2 (0.77) ATMHCAR2TSHRHPGDMAPT
Acrylic Acid SCHEMBL1672112 0.87 TSHR (0.71) ATMHCAR2TSHRHPGDMAPT
Butyl Fumarate SCHEMBL3415832 0.84 HCAR2 (0.73) ATMHCAR2TSHRHPGDMAPT
Propionic Acid SCHEMBL28771071 0.83 ATM (0.83) ATMHCAR2TSHRHPGDMAPT
SCHEMBL28215076 0.83 TSHR (0.66) ATMHCAR2TSHRHPGDNPSR1
Ethylene SCHEMBL11884689 0.83 ATM (0.91) ATMHCAR2TSHRHPGDMAPT
Ethylene SCHEMBL11884679 0.83 ATM (0.91) ATMHCAR2TSHRHPGDMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105907344-A Environment-friendly SBS furniture adhesive and preparing process thereof 韩立 2016-08-31 CN claimed
CN-105907344-A Environment-friendly SBS furniture adhesive and preparing process thereof 韩立 2016-08-31 CN disclosed
US-6143817-A POLYASPARTIC ACID AND/OR POLYGLUTAMIC ACID DERIVATIVES NATIONAL STARCH & CHEMICAL CO. (US) 2000-11-07 US disclosed