SCHEMBL7848596

SCHEMBL7848596

CC(=O)N1CCN(C(=O)c2ccc(F)cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.62
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
CA7 P43166 1/20 0.61
CA9 Q16790 1/20 0.61
CA14 Q9ULX7 1/20 0.61
HSD11B1 P28845 3/20 0.59
EPHX2 P34913 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.58
HSP90AA1 P07900 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
SLC6A7 Q99884 1/20 0.55
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54

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
SCHEMBL22305103 0.90 CA12 (0.71) POLBCA12CA1CA2CA7
SCHEMBL6985975 0.90 CA12 (0.71) POLBCA12CA1CA2CA7
SCHEMBL9364495 0.85 EPHX2 (0.77) POLBCA12CA1CA2CA7
SCHEMBL17573009 0.83 HSP90AA1 (0.54) POLBHSP90AA1SMN1; SMN2MEN1KMT2A
SCHEMBL3047748 0.83 CA12 (0.63) POLBCA12CA1CA2CA7
SCHEMBL10194850 0.83 PKM (0.72) HSP90AA1MEN1KMT2ASLC6A7KDM4E
SCHEMBL643480 0.82 ALDH1A1 (0.69) POLBCA12CA1CA2CA7
SCHEMBL31334408 0.82 HPGD (0.76) POLBCA12CA1CA2CA7
SCHEMBL28231369 0.82 POLB (0.58) POLBCA12CA1CA2CA7
SCHEMBL2646094 0.81 HPGD (0.70) POLBCA12CA1CA2CA7

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
EP-1118612-A1 Piperazine derivatives possesing nootropic activity Universita Degli Studi di Firenze (IT) 2001-07-25 EP claimed
EP-1118612-A1 Piperazine derivatives possesing nootropic activity Universita Degli Studi di Firenze (IT) 2001-07-25 EP disclosed