SCHEMBL11044746

SCHEMBL11044746

CCOC(=O)CC1CCCCC1C(C)CC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.37
CYP2D6 P10635 1/20 0.37
POLB P06746 1/20 0.36
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALDH1A1 P00352 4/20 0.33
TRPA1 O75762 1/20 0.32
APOBEC3A P31941 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
THRB P10828 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CASP6 P55212 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
SCHEMBL15653541 0.81 MGAM (0.46) KMT2ACYP2D6POLBMGAMGAA
SCHEMBL5679969 0.80 KDM4E (0.46) KMT2AKDM4ETSHRHSD17B10
SCHEMBL10940196 0.79 TSHR (0.36) KDM4ETSHRHSD17B10
SCHEMBL6691923 0.78 CA1 (0.47) KMT2ACYP2D6POLBMGAMGAA
SCHEMBL8252634 0.78 CA1 (0.47) KMT2ACYP2D6POLBMGAMGAA
SCHEMBL31645178 0.78 CA1 (0.47) KMT2ACYP2D6POLBMGAMGAA
SCHEMBL27728326 0.77 KMT2A (0.41) KMT2ACYP2D6POLBMGAMGAA
SCHEMBL31585111 0.75 CA1 (0.42) KMT2ACYP2D6POLBMGAMGAA
SCHEMBL24784339 0.74 TRPM8 (0.34) KMT2APOLBKDM4ETRPM8TSHR
SCHEMBL19227927 0.73 ALDH1A1 (0.41) KMT2ACYP2D6POLBMGAMGAA

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
US-4457862-A DIKETONE PERFUMES GIVAUDAN CORPORATION (US) 1984-07-03 US disclosed