SCHEMBL11503592

SCHEMBL11503592

CC(=O)CC(C)(C)/C=C(\C)C(N)=O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.31
MAPK1 P28482 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
SCHEMBL11503593 1.00 TRPA1 (0.31) TRPA1MAPK1
SCHEMBL3225658 0.80 MAPK1 (0.31) MAPK1
SCHEMBL3225664 0.80 MAPK1 (0.31) MAPK1
SCHEMBL1142234 0.80 HMGCR (0.32) TRPA1
SCHEMBL6726481 0.80 KDM4E (0.32) MAPK1
SCHEMBL28154184 0.80 KDM4E (0.32) MAPK1
Ammonia Solution, Strong SCHEMBL5698791 0.78 MAPK1 (0.30) MAPK1
SCHEMBL337182 0.78 MAPK1 (0.30) MAPK1
SCHEMBL4531663 0.78 MAPK1 (0.30) MAPK1
SCHEMBL15846389 0.77 MAPK1 (0.33) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4172732-A CONTAINING COPOLYMER OF STYRENE COMPONENT, A MALEIC ACID COMPONENT, AND A STYRENE COMPONENT FUJI PHOTO FILM CO., LTD. (JP) 1979-10-30 US disclosed