SCHEMBL9491640

SCHEMBL9491640

CCCCC(CC)CNC(=O)OCCO

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.58
HRH4 Q9H3N8 1/20 0.56
HRH3 Q9Y5N1 1/20 0.56
TSHR P16473 3/20 0.46
CYP3A4 P08684 2/20 0.46
ALDH1A1 P00352 2/20 0.46
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GLA P06280 1/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL844954 0.85 HRH4 (0.53) ACHEHRH4HRH3TSHRCYP3A4
SCHEMBL8966450 0.83 HRH4 (0.55) ACHEHRH4HRH3TSHRCYP3A4
SCHEMBL28598856 0.83 TSHR (0.57) HRH4HRH3TSHRCYP3A4ALDH1A1
Ammonia Solution, Strong SCHEMBL9998720 0.83 TSHR (0.57) HRH4HRH3TSHRCYP3A4ALDH1A1
SCHEMBL23878446 0.83 TSHR (0.57) HRH4HRH3TSHRCYP3A4ALDH1A1
SCHEMBL24928820 0.82 TSHR (0.53) HRH4HRH3TSHRCYP3A4ALDH1A1
SCHEMBL15128210 0.81 HRH4 (0.54) ACHEHRH4HRH3TSHRCYP3A4
SCHEMBL31299226 0.81 HRH4 (0.50) HRH4HRH3TSHRCYP3A4ALDH1A1
SCHEMBL23436333 0.81 HRH4 (0.50) HRH4HRH3TSHRCYP3A4ALDH1A1
SCHEMBL21359048 0.81 ACHE (0.50) ACHEHRH4HRH3ALDH1A1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0285650-A1 SOLVENT BORNE HIGH SOLIDS COATING COMPOSITIONS. UNION CARBIDE CORP (US) 1988-10-12 EP claimed
WO-1988002766-A1 SOLVENT BORNE HIGH SOLIDS COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1988-04-21 WO claimed
EP-0302222-B1 HIGH SOLIDS COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1993-03-03 EP disclosed
EP-0285650-B1 SOLVENT BORNE HIGH SOLIDS COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1992-10-07 EP disclosed
US-5115015-A Curable coatings and cured coatings with reactive diluents containing carbamates and crosslinking agents UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1992-05-19 US disclosed
US-4814382-A HYDROXYALKYL CARBAMATE REACTIVE DILUENTS, FILMS UNION CARBIDE CORPORATION (US) 1989-03-21 US disclosed
EP-0302222-A2 High solids coating compositions UNION CARBIDE CORPORATION (US) 1989-02-08 EP disclosed
EP-0285650-A1 SOLVENT BORNE HIGH SOLIDS COATING COMPOSITIONS. UNION CARBIDE CORP (US) 1988-10-12 EP disclosed
WO-1988002766-A1 SOLVENT BORNE HIGH SOLIDS COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1988-04-21 WO disclosed
EP-0233253-A1 CARBAMATE COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1987-08-26 EP disclosed
US-4677168-A Water borne high solids coating compositions UNION CARBIDE CORPORATION, 1987-06-30 US disclosed
WO-1987000851-A1 CARBAMATE COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1987-02-12 WO disclosed
EP-0196112-A2 Aqueous high solids coating compositions UNION CARBIDE CORPORATION (US) 1986-10-01 EP disclosed