SCHEMBL19702964

SCHEMBL19702964

CC(C)(C)N1C(=O)CC(C2CC(=O)N(C(C)(C)C)C2=O)C1=O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP2D6 P10635 1/20 0.40
MAPK1 P28482 1/20 0.40
POLB P06746 1/20 0.34
HIF1A Q16665 2/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL12219733 0.79 POLB (0.33) CYP2C19HSD17B10CYP2D6MAPK1POLB
SCHEMBL18811909 0.79 POLB (0.33) CYP2C19HSD17B10CYP2D6MAPK1POLB
SCHEMBL11885308 0.77 ADAM17 (0.38) CYP2C19HSD17B10CYP2D6MAPK1POLB
SCHEMBL19599188 0.77 CYP2C19 (0.38) CYP2C19HSD17B10CYP2D6MAPK1POLB
SCHEMBL19599183 0.77 CYP2C19 (0.38) CYP2C19HSD17B10CYP2D6MAPK1POLB
SCHEMBL14275619 0.77 MAPT (0.36) CYP2C19HSD17B10CYP2D6MAPK1POLB
SCHEMBL20228114 0.77 MT-CO2 (0.33) CYP2C19HSD17B10CYP2D6MAPK1POLB
SCHEMBL1753618 0.77 MT-CO2 (0.33) CYP2C19HSD17B10CYP2D6MAPK1POLB
SCHEMBL19599173 0.76 CYP2C19 (0.41) CYP2C19HSD17B10CYP2D6MAPK1POLB
SCHEMBL11930016 0.75 HSD17B10 (0.42) CYP2C19HSD17B10CYP2D6MAPK1HIF1A

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
US-10550287-B2 Solvent-free silicone-modified polyimide resin composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-02-04 US disclosed
US-10421840-B2 Silicone-modified polyimide resin composition of solvent free type SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-09-24 US disclosed
US-20170355825-A1 SILICONE-MODIFIED POLYIMIDE RESIN COMPOSITION OF SOLVENT FREE TYPE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-12-14 US disclosed
US-20170355825-A1 SILICONE-MODIFIED POLYIMIDE RESIN COMPOSITION OF SOLVENT FREE TYPE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-12-14 US disclosed