SCHEMBL1923484

SCHEMBL1923484

NCCCNCCCOCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.47
DRD4 P21917 2/20 0.47
DRD3 P35462 2/20 0.47
TSHR P16473 1/20 0.47
SIGMAR1 Q99720 3/20 0.46
HTR1A P08908 3/20 0.44
ADRA1D P25100 3/20 0.44
ADRA1A P35348 3/20 0.44
ADRA1B P35368 3/20 0.44
CHRM2 P08172 1/20 0.43

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
SCHEMBL11935005 0.87 SIGMAR1 (0.49) TSHRSIGMAR1CHRM2
SCHEMBL6239315 0.86 TSHR (0.50) DRD2DRD4DRD3TSHRSIGMAR1
SCHEMBL16620502 0.85 TSHR (0.54) DRD2DRD4DRD3TSHRSIGMAR1
SCHEMBL2782 0.85 TSHR (0.58) TSHR
SCHEMBL4574564 0.83 TSHR (0.56) TSHR
SCHEMBL21207996 0.83 TSHR (0.44) DRD2DRD4DRD3TSHRHTR1A
SCHEMBL1343622 0.83 NPC1 (0.57) DRD2DRD4DRD3TSHRSIGMAR1
SCHEMBL12147816 0.83 NPC1 (0.50) DRD2DRD4DRD3TSHRSIGMAR1
SCHEMBL25985295 0.83 TSHR (0.47) DRD2DRD4DRD3TSHRSIGMAR1
SCHEMBL15341674 0.82 MAOA (0.62) DRD2DRD4DRD3TSHRSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981944-B1 EPOXY BASED COATINGS PPG BV (NL) 2016-01-20 EP disclosed
EP-1504051-B1 ORGANO-FUNCTIONAL POLYSILOXANES SIGMAKALON SERVICES B V (NL) 2011-06-08 EP disclosed
US-20090068473-A1 Epoxy Based Coatings PPG B.V. (NL) 2009-03-12 US disclosed
EP-1981944-A1 EPOXY BASED COATINGS PPG B.V. (NL) 2008-10-22 EP disclosed
WO-2007054304-A1 EPOXY BASED COATINGS PPG B.V. (NL) 2007-05-18 WO disclosed
US-7118621-B2 Organo-functional polysiloxanes SIGMAKALON SERVICES B.V. (NL) 2006-10-10 US disclosed
US-20050202257-A1 Organo-functional polysiloxanes SIGMAKALON SERVICES B.V. (NL) 2005-09-15 US disclosed
US-20050148752-A1 Amino-functional polysiloxanes and their use in coatings SIGMAKALON SERVICES B.V. (NL) 2005-07-07 US disclosed
EP-1526150-A1 Anti-skid coating compositions SigmaKalon Services B.V. (NL) 2005-04-27 EP disclosed
EP-1504051-A1 ORGANO-FUNCTIONAL POLYSILOXANES SigmaKalon Services B.V. (NL) 2005-02-09 EP disclosed
EP-1501884-A1 AMINO-FUNCTIONAL POLYSILOXANES AND THEIR USE IN COATINGS SigmaKalon Services B.V. (NL) 2005-02-02 EP disclosed
WO-2003093352-A1 AMINO-FUNCTIONAL POLYSILOXANES AND THEIR USE IN COATINGS SIGMAKALON SERVICES B.V. (NL) 2003-11-13 WO disclosed
WO-2003093350-A1 ORGANO-FUNCTIONAL POLYSILOXANES SIGMAKALON SERVICES B.V. (NL) 2003-11-13 WO disclosed
EP-1361245-A1 Amino-functional polysiloxanes SigmaKalon Group B.V. (NL) 2003-11-12 EP disclosed
EP-1359182-A1 Organo-functional polysiloxanes SigmaKalon Group B.V. (NL) 2003-11-05 EP disclosed
WO-2003043973-A2 AMINE PHENOLIC COMPOUNDS AND THEIR USE AS HARDENERS AND/OR ACCELERATORS IN EPOXY COATINGS SIGMA COATINGS B.V. (NL) 2003-05-30 WO disclosed
EP-1314716-A1 Amine phenolic compounds and their use as hardener and/or accelerators in epoxy coatings SIGMA COATINGS B.V. (NL) 2003-05-28 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050202257-A1 Organo-functional polysiloxanes H1-3, HAO2, LPO DRD2 999/4885DRD4 715/4885DRD3 535/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.