SCHEMBL487138

SCHEMBL487138

O=C(OCC=C1CCCCC1)c1ccc(C(=O)OCCO)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
CYP2D6 P10635 2/20 0.39
TSHR P16473 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
SLC6A2 P23975 2/20 0.37
ESR1 P03372 2/20 0.37
ALDH1A1 P00352 2/20 0.37
CHRM1 P11229 1/20 0.37
KDR P35968 1/20 0.37
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 2/20 0.36
MAPK1 P28482 1/20 0.36
NR1H2 P55055 1/20 0.36
RNASEL Q05823 1/20 0.36
RAB9A P51151 2/20 0.35

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
SCHEMBL45096 0.91 KMT2A (0.42) KMT2AMEN1CYP2D6ESR1ALDH1A1
SCHEMBL3885032 0.79 RAB9A (0.41) KMT2AMEN1RAB9ANPC1
SCHEMBL26378 0.77 TDP1 (0.56) KMT2AMEN1CYP2D6TSHRTDP1
Cyclohexane SCHEMBL22501390 0.76 TDP1 (0.48) KMT2AMEN1CYP2D6TSHRTDP1
SCHEMBL12148891 0.76 TSHR (0.44) CYP2D6TSHRTDP1SLC6A2ESR1
SCHEMBL8350541 0.76 TDP1 (0.48) KMT2AMEN1CYP2D6TSHRTDP1
Cyclopropane SCHEMBL8344846 0.76 TDP1 (0.48) KMT2AMEN1CYP2D6TSHRTDP1
SCHEMBL13292517 0.75 TDP1 (0.54) KMT2AMEN1CYP2D6TSHRTDP1
Lithium SCHEMBL30805733 0.75 TDP1 (0.54) KMT2AMEN1CYP2D6TSHRTDP1
SCHEMBL19235060 0.75 TDP1 (0.54) KMT2AMEN1CYP2D6TSHRTDP1

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 197 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11969309-B2 Tooth repositioning system SOLVENTUM INTELLECTUAL PROPERTIES COMPANY (US) 2024-04-30 US claimed
WO-2024057191-A1 HIGH MODULUS FILM COMPOSITIONS WITH IMPROVED FORCE PERSISTENCE AND DENTAL APPLIANCES FORMED THEREFROM SOLVENTUM INTELLECTUAL PROPERTIES COMPANY (US) 2024-03-21 WO claimed
US-20230364851-A1 METHOD OF THERMOFORMING MULTILAYER POLYMER FILM AND ARTICLES 3M INNOVATIVE PROPERTIES COMPANY 2023-11-16 US claimed
WO-2023209520-A1 MULTI-LAYERED SYRINGE WITH A THREADED CONNECTION PART AND METHOD OF MANUFACTURING SAME PFIZER INC. (US) 2023-11-02 WO claimed
US-20230200944-A1 TOOTH REPOSITIONING SYSTEM SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2023-06-29 US claimed
EP-4200131-A1 METHOD OF THERMOFORMING MULTILAYER POLYMER FILM AND ARTICLES 3M Innovative Properties Company (US) 2023-06-28 EP claimed
CN-113121988-B Composite material and foam prepared from same 财团法人工业技术研究院 2023-05-30 CN claimed
EP-4171434-A1 TOOTH REPOSITIONING SYSTEM 3M Innovative Properties Company (US) 2023-05-03 EP claimed
EP-4084951-A1 DENTAL APPLIANCE WITH FUNCTIONAL STRUCTURES & TRANSFER ARTICLES USED IN FORMING SUCH APPLIANCES 3M Innovative Properties Company (US) 2022-11-09 EP claimed
US-11434334-B2 Composite material and foam prepared from the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2022-09-06 US claimed
EP-3131968-A1 HIGH HEAT POLYCARBONATE COMPOSITIONS SABIC Global Technologies B.V. (NL) 2017-02-22 EP claimed
EP-3131966-A1 HIGH HEAT POLYCARBONATE COMPOSITIONS SABIC Global Technologies B.V. (NL) 2017-02-22 EP claimed
EP-3131969-A1 HIGH HEAT POLYCARBONATE COMPOSITIONS SABIC Global Technologies B.V. (NL) 2017-02-22 EP claimed
US-20170037243-A1 HIGH HEAT POLYCARBONATE COMPOSITIONS SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2017-02-09 US claimed
US-20170022361-A1 HIGH HEAT POLYCARBONATE COMPOSITIONS SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2017-01-26 US claimed
US-20170022362-A1 HIGH HEAT POLYCARBONATE COMPOSITIONS SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2017-01-26 US claimed
WO-2015160961-A1 HIGH HEAT POLYCARBONATE COMPOSITIONS SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2015-10-22 WO claimed
WO-2015160963-A1 HIGH HEAT POLYCARBONATE COMPOSITIONS SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2015-10-22 WO claimed
WO-2015160957-A1 HIGH HEAT POLYCARBONATE COMPOSITIONS SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2015-10-22 WO claimed
US-20100195234-A1 LUMINANCE-ENHANCED FILM WOONGJIN CHEMICAL CO., LTD. 2010-08-05 US claimed