SCHEMBL11441415

SCHEMBL11441415

CN(C(=O)Nc1ccccc1)C1CCNCC1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.73
▸ TP53 P04637 1/20 0.60
▸ NPY5R Q15761 2/20 0.52
▸ RAB9A P51151 3/20 0.51
▸ POLB P06746 1/20 0.50
▸ ABCC1 P33527 1/20 0.50
▸ KMT2A Q03164 1/20 0.49
▸ DCUN1D1 Q96GG9 1/20 0.48
▸ CCR5 P51681 3/20 0.47
▸ JAK3 P52333 1/20 0.46
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A4 P31645 1/20 0.45
▸ KCNH2 Q12809 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
SCHEMBL11599130 0.84 ATM (1.00) ATMTP53NPY5RRAB9APOLB
SCHEMBL14141312 0.81 KCNH2 (0.53) ATMTP53RAB9APOLBKMT2A
SCHEMBL5725407 0.79 ATM (0.69) ATMTP53NPY5RRAB9APOLB
SCHEMBL13543091 0.78 ATM (0.49) ATMTP53NPY5RRAB9APOLB
Hydrochloric Acid SCHEMBL7667104 0.78 SLC6A4 (0.54) ATMTP53POLBDCUN1D1CCR5
SCHEMBL2959297 0.77 DCUN1D1 (0.75) DCUN1D1
SCHEMBL3809371 0.76 SLC6A4 (0.51) CCR5SLC6A2SLC6A4KCNH2
SCHEMBL14336844 0.75 NPY5R (0.69) ATMNPY5RCCR5
SCHEMBL14337147 0.75 NPY5R (0.69) ATMNPY5RCCR5
SCHEMBL15273035 0.73 POLB (0.55) ATMTP53POLBKMT2A

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
EP-0013878-A1 3-Aminopropoxyaryl derivatives, their preparation and pharmaceutical compositions containing them SANDOZ AG (CH) 1980-08-06 — — EP disclosed
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