SCHEMBL28040662

SCHEMBL28040662

CC=C(C)C(=O)O.CCOn1c(=O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
TSHR P16473 1/20 0.30
APEX1 P27695 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
SCHEMBL1123731 0.81 PKM (0.35) SMN1; SMN2TSHR
Acrylic Acid SCHEMBL28110853 0.81 LMNA (0.33) SMN1; SMN2TSHR
Acrylic Acid SCHEMBL29791382 0.81 LMNA (0.33) SMN1; SMN2TSHR
SCHEMBL27675441 0.76 APEX1 (0.35) SMN1; SMN2APEX1
Terephthalic Acid SCHEMBL28287418 0.76 PLA2G4B (0.44) SMN1; SMN2TSHR
SCHEMBL28331322 0.75 APEX1 (0.37) APEX1
Acrylic Acid SCHEMBL28849264 0.72 ALDH1A1 (0.30) SMN1; SMN2
SCHEMBL334929 0.71
Ether SCHEMBL27466854 0.67 ALDH1A1 (0.39) TSHR
SCHEMBL3996592 0.67 APEX1 (0.33) APEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109880062-A A kind of cross-linkable solidifying material and its continuous production method 广东博兴新材料科技有限公司 2019-06-14 CN claimed
CN-110507561-A The lip composition of emulsion form and the processing method for using it OREAL 2019-11-29 CN disclosed
CN-105228701-B The device of liquid lip composition comprising inverted emulsion form and porous application component 莱雅公司 2019-10-25 CN disclosed
CN-109880062-A A kind of cross-linkable solidifying material and its continuous production method 广东博兴新材料科技有限公司 2019-06-14 CN disclosed
CN-105228701-A Comprise the device that the liquid lip composition of inverted emulsion form and porous use component OREAL 2016-01-06 CN disclosed
CN-105102069-A Lipstick compositions in emulsion form comprising specific film-forming polymers and treatment methods using same OREAL 2015-11-25 CN disclosed