SCHEMBL4164892

SCHEMBL4164892

CCCCC(CC)CNC(=O)C#CC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.47
ALDH1A1 P00352 4/20 0.47
CYP3A4 P08684 2/20 0.47
HTT P42858 3/20 0.45
GLA P06280 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 2/20 0.42
MAPK1 P28482 2/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CA2 P00918 3/20 0.41
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP14 P50281 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL1931195 0.79 TSHR (0.57) TSHRALDH1A1CYP3A4HTTGLA
SCHEMBL19873325 0.78 TSHR (0.55) TSHRALDH1A1CYP3A4HTTGLA
Ammonia Solution, Strong SCHEMBL22444382 0.78 TSHR (0.55) TSHRALDH1A1CYP3A4HTTGLA
SCHEMBL5933289 0.78 TSHR (0.55) TSHRALDH1A1CYP3A4HTTGLA
SCHEMBL19873329 0.78 TSHR (0.55) TSHRALDH1A1CYP3A4HTTGLA
SCHEMBL19873327 0.78 TSHR (0.55) TSHRALDH1A1CYP3A4HTTGLA
SCHEMBL3966075 0.77 TSHR (0.59) TSHRALDH1A1CYP3A4HTTGLA
SCHEMBL16312309 0.77 TSHR (0.59) TSHRALDH1A1CYP3A4HTTGLA
SCHEMBL17226444 0.76 TSHR (0.53) TSHRALDH1A1CYP3A4HTTGLA
SCHEMBL16312317 0.75 TSHR (0.57) TSHRALDH1A1CYP3A4HTTGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247680-A1 ADHESION PROMOTING ADDITIVE AVERY DENNISON CORPORATION (US) 2009-10-01 US disclosed
CN-101460569-A Adhesion promoting additive AVERY DENNISON CORP (US) 2009-06-17 CN disclosed
EP-2024440-A2 ADHESION PROMOTING ADDITIVE AVERY DENNISON CORPORATION (US) 2009-02-18 EP disclosed
WO-2007146603-A2 ADHESION PROMOTING ADDITIVE AVERY DENNISON CORPORATION (US) 2007-12-21 WO disclosed
EP-0140530-B1 LATENTLY-CURABLE ORGANOSILICONE RELEASE COATING COMPOSITION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-03-08 EP disclosed
US-4533575-A ETHYLENICALLY UNSATURATED POLYSILOXANE AND POLYHYDROSILOXANE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-08-06 US disclosed
EP-0140530-A1 Latently-curable organosilicone release coating composition MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-05-08 EP disclosed
US-4504645-A GELATION INHIBITION USING A MONOESTER OR -AMIDE OF AN UNSATURATED DICARBOXYLIC ACID; SHELF LIFE; HEAT CURING MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-03-12 US disclosed