SCHEMBL28087003

SCHEMBL28087003

CC(C)(C)C(=O)ON1CCC(OCCc2cccc(Cl)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
BCHE P06276 1/20 0.41
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTR2C P28335 2/20 0.38
HTR2B P41595 2/20 0.38
SLC6A4 P31645 2/20 0.38
HTR6 P50406 2/20 0.38
SIGMAR1 Q99720 1/20 0.37
GLA P06280 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
GRM2 Q14416 1/20 0.37
GRM3 Q14832 1/20 0.37
EPHX2 P34913 1/20 0.37

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
SCHEMBL28832682 0.86 HPGD (0.41) CARM1PRMT6BCHESMN1; SMN2
SCHEMBL6424545 0.83 SMN1; SMN2 (0.55) SMN1; SMN2POLB
SCHEMBL28086939 0.80 BCHE (0.47) CARM1PRMT6BCHESMN1; SMN2SIGMAR1
SCHEMBL28751511 0.78 EPHX2 (0.49) POLBL3MBTL1HTR2CSLC6A4EPHX2
SCHEMBL28943532 0.77 PNMT (0.43) KDM4ESMN1; SMN2POLBL3MBTL1
SCHEMBL27638858 0.76 CARM1 (0.50) CARM1PRMT6BCHESIGMAR1
SCHEMBL27787081 0.72 POLB (0.47) POLBEPHX2
SCHEMBL6424398 0.72 HTR2C (0.51) CARM1PRMT6HTR2CHTR2BSLC6A4
SCHEMBL27658735 0.71 LIPC (0.36)
SCHEMBL28078742 0.71 FPR2 (0.51) SMN1; SMN2EPHX2

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
CN-104520292-B Sulphonylpiperidine derivant and they are for treating the purposes of disease of front dynein mediation 武田药品工业株式会社 2016-09-14 CN disclosed