SCHEMBL9550398

SCHEMBL9550398

C=C(C)C(=O)NC(=O)/C=C\C(=O)NC(=O)C(=C)C

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.39
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.32
CACNA1B Q00975 1/20 0.32
APBA1 Q02410 1/20 0.32
RXFP1 Q9HBX9 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL491406 0.91 ALDH1A1 (0.43) TGFBR1ALDH1A1TDP1GAA
SCHEMBL491408 0.91 ALDH1A1 (0.43) TGFBR1ALDH1A1TDP1GAA
SCHEMBL15422359 0.88 TGFBR1 (0.35) TGFBR1ALDH1A1TDP1KDM4E
SCHEMBL15422360 0.88 TGFBR1 (0.35) TGFBR1ALDH1A1TDP1KDM4E
SCHEMBL1414999 0.82 ALDH1A1 (0.41) TGFBR1ALDH1A1TDP1KDM4ERXFP1
SCHEMBL28514326 0.82 ALDH1A1 (0.35) TGFBR1ALDH1A1TDP1KDM4ERXFP1
SCHEMBL7171041 0.80 ALDH1A1 (0.45) TGFBR1ALDH1A1TDP1KDM4ERXFP1
SCHEMBL78126 0.80 ALDH1A1 (0.45) TGFBR1ALDH1A1TDP1KDM4ERXFP1
SCHEMBL1172960 0.77 MAPT (0.45) ALDH1A1MAPTCACNA1BAPBA1
Methacrylic Acid SCHEMBL6231224 0.77 ALDH1A1 (0.39) TGFBR1ALDH1A1TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5216173-A Curing agents for epoxy resins; polyimides HENKEL RESEARCH CORPORATION (US) 1993-06-01 US disclosed
EP-0484381-A1 N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF HENKEL RESEARCH CORPORATION (US) 1992-05-13 EP disclosed
WO-1991001307-A2 N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF HENKEL RESEARCH CORPORATION (US) 1991-02-07 WO disclosed
US-4356109-A POLYMERIZING UREA AND FORMALDEHYDE IN PRESENCE OF ANIONIC POLYELECTROLYTE AND AN AMMONIUM SALT OF AN ACID FUJI PHOTO FILM CO., LTD. (JP) 1982-10-26 US disclosed
US-4251386-A BY POLYMERIZATION OF UREA AND FORMALDEHYDE IN AN ANIONIC POLYELECTROLYTE AND AN AMMONIUM SALT OF AN ACID FUJI PHOTO FILM CO., LTD. (JP) 1981-02-17 US disclosed
US-4221710-A PRESSURE SENSITIVE RECORDING SHEET FUJI PHOTO FILM CO., LTD. (JP) 1980-09-09 US disclosed