SCHEMBL9329015

SCHEMBL9329015

C=C(C)C(=O)NC(C)CO.COC(C)OC

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 2/20 0.49
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.32
RXFP1 Q9HBX9 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
SCHEMBL9193899 0.89 TGFBR1 (0.59) TGFBR1ALDH1A1TSHRRXFP1
SCHEMBL30856800 0.76 TGFBR1 (0.53) TGFBR1ALDH1A1TSHRRXFP1
SCHEMBL22773433 0.76 MEN1 (0.44) TGFBR1ALDH1A1TSHR
SCHEMBL21925692 0.73 ALDH1A1 (0.38) TGFBR1ALDH1A1TSHR
SCHEMBL4338104 0.73 ALDH1A1 (0.38) TGFBR1ALDH1A1TSHR
SCHEMBL24495943 0.73 TGFBR1 (0.46) TGFBR1ALDH1A1TSHRRXFP1
SCHEMBL29519156 0.73 TGFBR1 (0.50) TGFBR1ALDH1A1TSHRRXFP1
SCHEMBL554944 0.72 TGFBR1 (0.48) TGFBR1ALDH1A1TSHRRXFP1
SCHEMBL18641077 0.72 TGFBR1 (0.48) TGFBR1ALDH1A1TSHRRXFP1
SCHEMBL237335 0.72 TGFBR1 (0.44) TGFBR1ALDH1A1TSHRRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0350276-B1 Temporary wet strength resins with nitrogen heterocyclic nonnucleophilic functionalities and paper products containing same PROCTER & GAMBLE (US) 1994-04-06 EP disclosed
US-5138002-A Temporary wet strength resins with nitrogen heterocyclic nonnucleophilic functionalities and paper products containing same THE PROCTER & GAMBLE COMPANY (US) 1992-08-11 US disclosed
US-4981557-A Temporary wet strength resins with nitrogen heterocyclic nonnucleophilic functionalities and paper products containing same THE PROCTER & GAMBLE COMPANY (US) 1991-01-01 US disclosed
EP-0350276-A2 Temporary wet strength resins with nitrogen heterocyclic nonnucleophilic functionalities and paper products containing same THE PROCTER & GAMBLE COMPANY (US) 1990-01-10 EP disclosed