SCHEMBL900183

SCHEMBL900183

CCOC(=O)N1CCN(c2ccnc3ccccc23)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDE P14735 1/20 0.71
SMN1; SMN2 Q16637 2/20 0.59
GAA P10253 1/20 0.59
HTT P42858 1/20 0.58
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
PDGFRB P09619 1/20 0.55
LMNA P02545 1/20 0.55
ALDH1A1 P00352 2/20 0.54
MAPT P10636 1/20 0.54
AKT1 P31749 1/20 0.53
ADRB2 P07550 2/20 0.52
NCF1 P14598 1/20 0.52
FAAH O00519 1/20 0.52
MGLL Q99685 1/20 0.52
POLB P06746 1/20 0.51
DRD2 P14416 1/20 0.51
DRD3 P35462 1/20 0.51
HTR3E A5X5Y0 1/20 0.49
HTR3B O95264 1/20 0.49

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
SCHEMBL2422976 0.85 PDGFRB (0.55) IDEMEN1KMT2APDGFRBAKT1
SCHEMBL30060970 0.85 PDGFRB (0.57) IDESMN1; SMN2MEN1KMT2APDGFRB
SCHEMBL14515648 0.83 CLK1 (0.68) IDESMN1; SMN2MEN1KMT2APDGFRB
SCHEMBL6186988 0.82 MAPT (0.57) IDESMN1; SMN2HTTMEN1KMT2A
SCHEMBL27486036 0.82 IDE (0.53) IDESMN1; SMN2GAAHTTMEN1
SCHEMBL899673 0.81 IDE (0.49) IDESMN1; SMN2MEN1KMT2APDGFRB
SCHEMBL20274129 0.81 CCR5 (0.57) IDESMN1; SMN2MEN1KMT2APDGFRB
SCHEMBL19422866 0.79 AKT1 (0.58) IDEMEN1KMT2APDGFRBAKT1
SCHEMBL5369080 0.77 POLB (0.54) IDEMEN1KMT2APDGFRBPOLB
SCHEMBL30572691 0.77 MEN1 (0.57) IDESMN1; SMN2GAAHTTMEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2621923-B1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES INTERVET INT BV (NL) 2017-03-29 EP disclosed
US-8883791-B2 N-heteroaryl compounds with cyclic bridging unit for the treatment of parasitic diseases INTERVET INC. (US) 2014-11-11 US disclosed
US-20130203768-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES INTERVET INC. 2013-08-08 US disclosed
EP-2621923-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES Intervet International B.V. (NL) 2013-08-07 EP disclosed
WO-2012041872-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES INTERVET INTERNATIONAL B.V. (NL) 2012-04-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130203768-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES PIGO, HNMT, PIGS IDE 1067/4885SMN1; SMN2 3476/4885GAA 891/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.