SCHEMBL8829186

SCHEMBL8829186

CC(C)(C)OC(=O)C1CCN(CCI)CC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.48
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
HPGD P15428 1/20 0.38
RECQL P46063 1/20 0.36
GAA P10253 1/20 0.36
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36
LMNA P02545 1/20 0.35
KCNA3 P22001 1/20 0.34
LTA4H P09960 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPT P10636 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
SCHEMBL7454861 0.85 HRH3 (0.49) HRH3ALDH1A1MEN1TSHRKMT2A
SCHEMBL19931764 0.85 HRH3 (0.49) HRH3ALDH1A1MEN1TSHRKMT2A
SCHEMBL9281583 0.84 SMN1; SMN2 (0.50) HRH3ALDH1A1MEN1TSHRKMT2A
SCHEMBL13965741 0.84 HRH3 (0.48) HRH3ALDH1A1MEN1TSHRKMT2A
SCHEMBL1052899 0.84 HRH3 (0.48) HRH3ALDH1A1MEN1TSHRKMT2A
SCHEMBL18915030 0.84 HRH3 (0.48) HRH3ALDH1A1MEN1TSHRKMT2A
SCHEMBL24709631 0.83 HRH3 (0.47) HRH3ALDH1A1MEN1TSHRKMT2A
SCHEMBL13975751 0.83 HRH3 (0.47) HRH3ALDH1A1MEN1TSHRKMT2A
SCHEMBL7749087 0.81 SMN1; SMN2 (0.55) HRH3ALDH1A1MEN1TSHRKMT2A
SCHEMBL7879735 0.81 HRH3 (0.51) HRH3ALDH1A1MEN1TSHRKMT2A

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-5646000-A FLUORESCENT PROBES FOR INDENTIFYING ANTIPLATELET AGENTS MERCK & CO., INC. (US) 1997-07-08 US disclosed
WO-1996010181-A1 COMPOUNDS AND METHODS FOR IDENTIFYING ACTIVATED PLATELETS MERCK & CO., INC. (US) 1996-04-04 WO disclosed