SCHEMBL9735378

SCHEMBL9735378

O=C1CCC(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3Cl)CC2)N1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 8/20 0.51
PARP1 P09874 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
IP6K1 Q92551 1/20 0.43
NAMPT P43490 2/20 0.43
CNR1 P21554 1/20 0.42
CHRM2 P08172 1/20 0.42

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
SCHEMBL9735575 0.85 RAB9A (0.56) LMNANAMPT
SCHEMBL9735854 0.84 KMT2A (0.58) PARP1MAPT
SCHEMBL9736130 0.79 NAMPT (0.61) LMNANAMPT
SCHEMBL7950888 0.78 NAMPT (0.51) PARP1L3MBTL1TSHRNAMPT
SCHEMBL7950882 0.78 NAMPT (0.51) PARP1L3MBTL1TSHRNAMPT
SCHEMBL9735532 0.77 PARP1 (0.49) PARP1L3MBTL1MAPTTP53
SCHEMBL9734613 0.76 GFER (0.50) PARP1NAMPT
SCHEMBL9734952 0.76 NAMPT (0.52) PARP1L3MBTL1NAMPT
SCHEMBL14825147 0.75 P2RX7 (0.62) P2RX7L3MBTL1MAPTLMNATP53
SCHEMBL11957909 0.75 MDM2 (0.48) PARP1NAMPTCNR1

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