SCHEMBL8900253

SCHEMBL8900253

N#CCC1CCC(C(N)=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ PLG P00747 1/20 0.38
▸ PLAT P00750 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MCL1 Q07820 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ GAA P10253 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ HSD11B1 P28845 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ JAK2 O60674 3/20 0.32
▸ TYK2 P29597 3/20 0.32
▸ JAK3 P52333 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ RECQL P46063 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31

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
SCHEMBL14737926 0.88 PLG (0.35) SMN1; SMN2PLGPLATLMNAMCL1
SCHEMBL14737925 0.88 PLG (0.35) SMN1; SMN2PLGPLATLMNAMCL1
SCHEMBL20501699 0.81 PLG (0.54) PLGPLATLMNAKMT2AALDH1A1
SCHEMBL20501700 0.81 PLG (0.54) PLGPLATLMNAKMT2AALDH1A1
SCHEMBL24228415 0.79 KMT2A (0.34) PLGPLATLMNAKMT2AALDH1A1
SCHEMBL2162286 0.76 JAK2 (0.33) KMT2AALDH1A1HSD11B1CYP3A4JAK2
SCHEMBL365047 0.76 — —
SCHEMBL24197645 0.76 JAK2 (0.33) KMT2AALDH1A1HSD11B1CYP3A4JAK2
SCHEMBL13907209 0.76 JAK2 (0.33) KMT2AALDH1A1HSD11B1CYP3A4JAK2
Bromide SCHEMBL30923588 0.74 — —

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
WO-1997020823-A2 2-AMINO QUINAZOLINE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 1997-06-12 — — WO disclosed
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