SCHEMBL12859352

SCHEMBL12859352

C=CCCN1CCC(C)CC1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.50
PRMT6 Q96LA8 1/20 0.50
PRMT1 Q99873 1/20 0.50
PRMT8 Q9NR22 1/20 0.50
SIGMAR1 Q99720 9/20 0.47
ACHE P22303 3/20 0.43
HRH3 Q9Y5N1 2/20 0.43
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
KDM4E B2RXH2 1/20 0.39
KCNA3 P22001 1/20 0.38

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
SCHEMBL21088308 0.80 SIGMAR1 (0.38) SIGMAR1
SCHEMBL30836864 0.78 SIGMAR1 (0.37) SIGMAR1
SCHEMBL2560880 0.78 CARM1 (0.50) CARM1PRMT6PRMT1PRMT8SIGMAR1
SCHEMBL12719804 0.78
SCHEMBL20234635 0.78 CARM1 (0.65) CARM1PRMT6PRMT1PRMT8SIGMAR1
SCHEMBL13602691 0.78 CYP2D6 (0.37) SIGMAR1HRH3
SCHEMBL13966102 0.77 CARM1 (0.42) CARM1PRMT6PRMT1PRMT8SIGMAR1
SCHEMBL82611 0.77 CARM1 (0.48) CARM1PRMT6PRMT1PRMT8SIGMAR1
SCHEMBL1196444 0.75 CARM1 (0.56) CARM1PRMT6PRMT1PRMT8SIGMAR1
SCHEMBL23828682 0.74 CARM1 (0.60) CARM1PRMT6PRMT1PRMT8SIGMAR1

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-2284172-A1 Immunomodulating heterocyclic compounds MediGene Ltd. (GB) 2011-02-16 EP disclosed