SCHEMBL2811935

SCHEMBL2811935

CC(O)OCCN(C)C.CCC(O)(CC)CN

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.31
CYP1A2 P05177 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
ADRA2A P08913 1/20 0.31
CYP2D6 P10635 1/20 0.31
CHRM1 P11229 1/20 0.31
TSHR P16473 1/20 0.31
ADRA2B P18089 1/20 0.31
CHRM3 P20309 1/20 0.31
SLC6A2 P23975 1/20 0.31
HRH2 P25021 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
OPRM1 P35372 1/20 0.31
DRD3 P35462 1/20 0.31

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
SCHEMBL29315685 0.80
SCHEMBL35893 0.80
SCHEMBL18047452 0.74
Trimethylammonium SCHEMBL5011755 0.71 FDPS (0.33)
SCHEMBL10669524 0.69 CA12 (0.46) LMNACYP1A2CHRM2CHRM4CHRM5
SCHEMBL8366 0.68
SCHEMBL8849598 0.68 CHRM2 (0.39) LMNACYP1A2CHRM2CHRM4CHRM5
SCHEMBL4203081 0.66 CHRM2 (0.38) LMNACYP1A2CHRM2CHRM4CHRM5
Hydroxyamine SCHEMBL16774690 0.66 FDPS (0.36) CYP2D6
Ammonia Solution, Strong SCHEMBL9336079 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8497316-B2 Crosslinkable and foaming polyester-polyurethane (hybrid) resin moulding compositions, with foaming characteristics for closed mould applications CCP COMPOSITES UK LTD (GB) 2013-07-30 US disclosed
US-20100239847-A1 Crosslinkable and Foaming Polyester-Polyurethane (Hybrid) Resin Moulding Compositions, with Foaming Characteristics for Closed Mould Applications U.S. BANK TRUSTEES LIMITED (GB) 2010-09-23 US disclosed
EP-2201056-A1 CROSSLINKABLE AND FOAMING POLYESTER-POLYURETHANE (HYBRID) RESIN MOULDING COMPOSITIONS, WITH FOAMING CHARACTERISTICS FOR CLOSED MOULD APPLICATIONS Cray Valley Ltd (GB) 2010-06-30 EP disclosed
WO-2009046902-A1 CROSSLINKABLE AND FOAMING POLYESTER-POLYURETHANE (HYBRID) RESIN MOULDING COMPOSITIONS, WITH FOAMING CHARACTERISTICS FOR CLOSED MOULD APPLICATIONS CRAY VALLEY LTD (GB) 2009-04-16 WO disclosed
EP-2048172-A1 Crosslinkable and foaming polyester-polyurethane (hybrid) resin moulding compositions, with foaming characteristics for closed mould applications CRAY VALLEY LTD (GB) 2009-04-15 EP disclosed