SCHEMBL6997281

SCHEMBL6997281

C=CCOC(=O)CCSCCC(=O)OCC=C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.44
PKM P14618 1/20 0.44
ALDH1A1 P00352 5/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
CYP3A4 P08684 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 3/20 0.37
LMNA P02545 2/20 0.37
KMT2A Q03164 2/20 0.37
EPHX2 P34913 1/20 0.36
MAPT P10636 1/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
SNCA P37840 1/20 0.30
MEN1 O00255 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
SCHEMBL5495599 0.92 TDP1 (0.52) TSHRSMN1; SMN2PKMALDH1A1GAA
SCHEMBL10454012 0.90 TSHR (0.49) TSHRSMN1; SMN2PKMALDH1A1GAA
SCHEMBL21768538 0.87 TSHR (0.53) TSHRSMN1; SMN2PKMALDH1A1GAA
SCHEMBL10598367 0.87 TSHR (0.46) TSHRSMN1; SMN2PKMALDH1A1GAA
SCHEMBL6998791 0.87 TSHR (0.46) TSHRSMN1; SMN2PKMALDH1A1GAA
SCHEMBL56403 0.84 TSHR (0.63) TSHRSMN1; SMN2PKMALDH1A1GAA
SCHEMBL2053300 0.82 TSHR (0.50) TSHRSMN1; SMN2PKMALDH1A1GAA
Ammonia Solution, Strong SCHEMBL29207431 0.81 TSHR (0.61) TSHRSMN1; SMN2PKMALDH1A1GAA
SCHEMBL28545578 0.81 TSHR (0.61) TSHRSMN1; SMN2PKMALDH1A1GAA
SCHEMBL7578576 0.81 TSHR (0.43) TSHRSMN1; SMN2PKMALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101006524-A Mica tape having maximized mica content ISOVOLTA (US) 2007-07-25 CN disclosed
EP-0946558-B1 ETHYLIDENE DERIVATIVES OF TRICYCLIC CARBAPENEMS LEK FARMACEVTSKA DRUZBA DD (SI) 2003-07-30 EP disclosed
EP-0860495-B1 Lubricating oil composition TONEN CORP (JP) 2003-01-08 EP disclosed
US-6489318-B1 INHIBITORS OF ACTION OF BETA-LACTAMASES AND/OR AS ANTIBIOTICS LEK, TOVARNA FARMACEVTSKIH IN KEMICNIH IZDELKOV, D.D. (SI) 2002-12-03 US disclosed
US-6147035-A DETERGENCY; HEAT AND OXIDATION RESISTANCE; REDUCE NITROGEN OXIDE EMISSION TONEN CORPORATION (JP) 2000-11-14 US disclosed
EP-0946558-A1 ETHYLIDENE DERIVATIVES OF TRICYCLIC CARBAPENEMS Lek Tovarna Farmacevtskih in Kemicnih Izdelkov, D.D. (SI) 1999-10-06 EP disclosed
EP-0860495-A2 Lubricating oil composition TONEN CORPORATION (JP) 1998-08-26 EP disclosed
WO-1998027094-A1 ETHYLIDENE DERIVATIVES OF TRICYCLIC CARBAPENEMS LEK TOVARNA FARMACEVTSKIH IN KEMIC^¿NIH IZDELKOV, D.D. (SI) 1998-06-25 WO disclosed
US-4251407-A ZINC OXIDE AND SALT OR ESTER OF FATTY ACID, CORROSION PREVENTION CAUSED BY ZIEGLER-TYPE CHLORINE RESIDUES SHELL OIL COMPANY (US) 1981-02-17 US disclosed