SCHEMBL24201112

SCHEMBL24201112

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

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.45
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL3286915 0.83 CYP2D6 (0.50) CYP2D6KDM4E
SCHEMBL524335 0.80 CYP2D6 (0.60) CYP2D6KDM4E
SCHEMBL8583588 0.80 CYP2D6 (0.60) CYP2D6KDM4E
SCHEMBL9883162 0.75 CYP2D6 (0.53) CYP2D6KDM4E
SCHEMBL296447 0.75
SCHEMBL10486974 0.73 TSHR (0.33)
SCHEMBL5432822 0.73 CYP2D6 (0.69) CYP2D6KDM4E
SCHEMBL831341 0.72 CYP2D6 (0.50) CYP2D6
SCHEMBL2721073 0.72 TSHR (0.33)
SCHEMBL3639921 0.72

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
EP-3497068-B1 PROCESS FOR MODIFICATION OF A SOLID SURFACE SURFIX B V (NL) 2022-01-19 EP disclosed