SCHEMBL9736130

SCHEMBL9736130

O=C1CCC(C(=O)N2CCN(c3ccc(Cl)cc3)CC2)N1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.61
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
GFER P55789 1/20 0.54
AKR1C3 P42330 6/20 0.50
LMNA P02545 3/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ADAMTS5 Q9UNA0 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TDP1 Q9NUW8 1/20 0.46
HSP90AA1 P07900 1/20 0.45

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
SCHEMBL9735951 0.87 NAMPT (0.61) NAMPTMEN1KMT2AAKR1C3ALDH1A1
SCHEMBL9735387 0.86 NAMPT (0.67) NAMPTMEN1KMT2ALMNAALDH1A1
SCHEMBL9736530 0.85 MAPT (0.61) NAMPTMEN1KMT2ALMNAALDH1A1
SCHEMBL9735854 0.84 KMT2A (0.58) MEN1KMT2AAKR1C3ALDH1A1HPGD
SCHEMBL9734450 0.84 NAMPT (0.58) NAMPTGFERAKR1C3LMNAALDH1A1
SCHEMBL9735532 0.82 PARP1 (0.49) KMT2AAKR1C3ALDH1A1HTTNPSR1
SCHEMBL7950882 0.81 NAMPT (0.51) NAMPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7950888 0.81 NAMPT (0.51) NAMPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL9734613 0.81 GFER (0.50) NAMPTMEN1KMT2AGFERALDH1A1
SCHEMBL9737198 0.81 NAMPT (0.54) NAMPTMEN1KMT2AAKR1C3LMNA

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
US-5102882-A Nootropic agents NIPPON SHINYAKU CO., LTD. (JP) 1992-04-07 US disclosed