SCHEMBL28844286

SCHEMBL28844286

CCCC(C)(N)CC(C)(C)CN

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.43
FDPS P14324 1/20 0.34
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL24225584 0.82 FDPS (0.31) FDPS
SCHEMBL28194490 0.80 CYP2D6 (0.36) CYP2D6FDPS
SCHEMBL12516837 0.79 CYP2D6 (0.47) CYP2D6FDPSLMNAHSD17B10KDM4E
SCHEMBL10909327 0.78
SCHEMBL12927009 0.76 FDPS (0.33) FDPS
SCHEMBL13308930 0.76 FDPS (0.33) FDPS
Hydrochloric Acid SCHEMBL3533776 0.76 FDPS (0.39) CYP2D6FDPS
SCHEMBL3837428 0.75
SCHEMBL2545678 0.74
SCHEMBL22448787 0.73 CYP2D6 (0.36) CYP2D6FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107743511-A The water-based print ink for poly- (methyl) acrylic ester adhesive that the polyurethane binder and moisture dissipated comprising moisture dissipates 巴斯夫欧洲公司 2018-02-27 CN disclosed
CN-107001903-A Aqueous adhesive dispersions comprising polyurethane and ethoxylized fatty alcohol 巴斯夫欧洲公司 2017-08-01 CN disclosed