SCHEMBL9735768

SCHEMBL9735768

O=C1CCC(C(=O)N2CCN(CC(=O)N3CCCCC3)CC2)N1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.49
TPSAB1 Q15661 1/20 0.43
TPSD1 Q9BZJ3 1/20 0.43
TPSG1 Q9NRR2 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
RECQL P46063 1/20 0.42
ALDH1A1 P00352 3/20 0.42
PARP1 P09874 2/20 0.42
NAMPT P43490 2/20 0.40
LMNA P02545 1/20 0.40
GFER P55789 1/20 0.39
TGM2 P21980 1/20 0.39
BIRC2 Q13490 1/20 0.39
MAPT P10636 1/20 0.38
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTT P42858 1/20 0.38
EPHX2 P34913 1/20 0.37
MEN1 O00255 2/20 0.37
TSHR P16473 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
SCHEMBL9734807 0.99 GAA (0.46) GAATPSAB1TPSD1TPSG1SMN1; SMN2
SCHEMBL9734899 0.96 GAA (0.54) GAATPSAB1TPSD1TPSG1SMN1; SMN2
SCHEMBL9735396 0.95 GAA (0.51) GAATPSAB1TPSD1TPSG1SMN1; SMN2
SCHEMBL9735618 0.88 ALOX15 (0.47) GAATPSAB1TPSD1TPSG1SMN1; SMN2
SCHEMBL9735111 0.87 TPSAB1 (0.41) GAATPSAB1TPSD1TPSG1SMN1; SMN2
SCHEMBL8824243 0.87 ALOX15 (0.51) GAATPSAB1TPSD1TPSG1SMN1; SMN2
Fasoracetam SCHEMBL23922653 0.86 HPGD (0.47) TPSAB1TPSD1TPSG1SMN1; SMN2ALDH1A1
Fasoracetam SCHEMBL9734362 0.86 HPGD (0.47) TPSAB1TPSD1TPSG1SMN1; SMN2ALDH1A1
Fasoracetam SCHEMBL194770 0.86 HPGD (0.47) TPSAB1TPSD1TPSG1SMN1; SMN2ALDH1A1
SCHEMBL9735864 0.86 HPGD (0.47) TPSAB1TPSD1TPSG1SMN1; SMN2ALDH1A1

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