SCHEMBL3787141

SCHEMBL3787141

CC(C)(CN)CN(C(C)(C)C)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.50
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL363890 0.73
Hydrochloric Acid SCHEMBL18340217 0.71 CYP2D6 (0.50) CYP2D6KDM4E
Hydrochloric Acid SCHEMBL9514552 0.71 CYP2D6 (0.50) CYP2D6KDM4E
SCHEMBL42682 0.69
SCHEMBL3787316 0.69
SCHEMBL24575774 0.69
SCHEMBL3791490 0.69 CYP2D6 (0.47) CYP2D6KDM4E
SCHEMBL8101253 0.67 TSHR (0.31)
SCHEMBL3792171 0.67 CYP2D6 (0.45) CYP2D6KDM4E
SCHEMBL22960191 0.67 CYP2D6 (0.45) CYP2D6KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2157215-B1 POLYURETHANE ELASTIC FIBER ASAHI KASEI FIBERS CORP (JP) 2011-12-28 EP disclosed
US-20100184347-A1 POLYURETHANE ELASTIC FIBERS ASAHI KASEI FIBERS CORPORATION (JP) 2010-07-22 US disclosed
EP-2157215-A1 POLYURETHANE ELASTIC FIBER Asahi Kasei Fibers Corporation (JP) 2010-02-24 EP disclosed