SCHEMBL5027628

SCHEMBL5027628

NC1(C(=O)N2CCC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 10/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 2/20 0.39
DPP9 Q86TI2 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL5031120 0.95 HSD11B1 (0.43) HSD11B1L3MBTL1ALDH1A1DPP9DPP7
SCHEMBL5031162 0.93 HSD11B1 (0.45) HSD11B1L3MBTL1ALDH1A1SMN1; SMN2LMNA
SCHEMBL10129621 0.86 MEN1 (0.46) HSD11B1L3MBTL1ALDH1A1SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL496002 0.84 MEN1 (0.44) HSD11B1L3MBTL1ALDH1A1SMN1; SMN2LMNA
SCHEMBL15076636 0.81 DPP9 (0.36) DPP9DPP7
SCHEMBL21880359 0.81 DPP9 (0.36) DPP9DPP7MEN1KMT2A
SCHEMBL15076715 0.79 DPP9 (0.50) HSD11B1DPP9DPP7
SCHEMBL5031123 0.79 GAA (0.50) L3MBTL1ALDH1A1DPP9DPP7SMN1; SMN2
SCHEMBL20163985 0.79 DPP7 (0.37) DPP9DPP7
SCHEMBL13321795 0.79 HSD11B1 (0.48) HSD11B1DPP9DPP7LMNAKMT2A

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-7429609-B2 Pyrazole compound and medicinal composition containing the same EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-09-30 US disclosed
EP-1510516-A1 PYRAZOLE COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME Eisai Co., Ltd. (JP) 2005-03-02 EP disclosed