SCHEMBL9816947

SCHEMBL9816947

CCC(CN)OC(=O)CN

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
MEN1 O00255 1/20 0.32
CYP2C19 P33261 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
PRKCA P17252 1/20 0.30
PRKCE Q02156 1/20 0.30
PRKCQ Q04759 1/20 0.30
PRKCD Q05655 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
SCHEMBL11879324 0.91 MAPT (0.36) MAPTMAPK1LMNAALDH1A1MEN1
SCHEMBL10923718 0.86 MEN1 (0.43) MAPTMAPK1LMNAALDH1A1MEN1
SCHEMBL27094638 0.81 TSHR (0.32) PRKCAPRKCD
SCHEMBL988073 0.79
SCHEMBL28666266 0.79
SCHEMBL27995045 0.78 MAPT (0.44) MAPTMAPK1LMNAALDH1A1CYP1A2
SCHEMBL4307077 0.77 MAPT (0.47) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL14660095 0.77 MAPK1 (0.66) MAPTMAPK1LMNAALDH1A1MEN1
SCHEMBL14659802 0.77 MAPK1 (0.66) MAPTMAPK1LMNAALDH1A1MEN1
SCHEMBL14659460 0.77 MAPK1 (0.66) MAPTMAPK1LMNAALDH1A1MEN1

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
US-4986983-A IMPROVING TEXTURE, FEEL AND APPEARANCE REVLON, INC. (US) 1991-01-22 US claimed
US-4986983-A IMPROVING TEXTURE, FEEL AND APPEARANCE REVLON, INC. (US) 1991-01-22 US disclosed