SCHEMBL24508702

SCHEMBL24508702

CNCCCCCNCC(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.46
HRH4 Q9H3N8 2/20 0.43
HRH3 Q9Y5N1 2/20 0.43
PAOX Q6QHF9 1/20 0.39
KISS1R Q969F8 1/20 0.35
SIGMAR1 Q99720 2/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2A Q12879 2/20 0.34
MAPT P10636 1/20 0.34
S1PR2 O95136 3/20 0.33
S1PR4 O95977 3/20 0.33
S1PR1 P21453 3/20 0.33
S1PR3 Q99500 3/20 0.33
ANPEP P15144 1/20 0.33
ERAP2 Q6P179 1/20 0.33
PKM P14618 1/20 0.33
CA2 P00918 1/20 0.33
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 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
SCHEMBL25557251 1.00 EPHX1 (0.46) EPHX1HRH4HRH3PAOXKISS1R
SCHEMBL25832099 1.00 EPHX1 (0.46) EPHX1HRH4HRH3PAOXKISS1R
SCHEMBL3348281 0.92 HRH4 (0.38) EPHX1HRH4HRH3PAOXKISS1R
SCHEMBL5298781 0.89 HRH4 (0.48) EPHX1HRH4HRH3GRIN1GRIN2A
SCHEMBL24379824 0.89 HRH4 (0.48) EPHX1HRH4HRH3GRIN1GRIN2A
SCHEMBL2483497 0.89 HRH4 (0.48) EPHX1HRH4HRH3GRIN1GRIN2A
SCHEMBL9624660 0.87 HRH4 (0.47) EPHX1HRH4HRH3GRIN1GRIN2A
SCHEMBL21107061 0.82 HTR1B (0.34) EPHX1HRH4HRH3PAOXKISS1R
SCHEMBL3318903 0.81
SCHEMBL2478778 0.81 HRH4 (0.42) EPHX1HRH4HRH3GRIN1GRIN2A

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
WO-2022125790-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-06-16 WO disclosed