SCHEMBL8397136

SCHEMBL8397136

CCNc1ncn(CC2CCCCC2)c2nc(C3CC3)nc1-2.CCNc1ncn(Cc2ccccc2)c2nc(C(C)C)nc1-2

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.35
CTSB P07858 1/20 0.35
PDE10A Q9Y233 2/20 0.34
YTHDC1 Q96MU7 1/20 0.33
PDE5A O76074 1/20 0.32
PDE4A P27815 3/20 0.32
PDE4B Q07343 3/20 0.32
PDE4C Q08493 3/20 0.32
PDE4D Q08499 3/20 0.32
CHRM3 P20309 2/20 0.32
HTR2C P28335 2/20 0.30
SLC6A4 P31645 2/20 0.30
ALDH1A1 P00352 1/20 0.30
PLA2G1B P04054 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ATG4B Q9Y4P1 1/20 0.30
HTR2A P28223 1/20 0.30

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
SCHEMBL8397096 0.87 CTSL (0.41) CTSLCTSBPDE10APDE5APDE4A
SCHEMBL1387933 0.84 YTHDC1 (0.41) CTSLCTSBPDE10AYTHDC1PDE4A
Hydrochloric Acid SCHEMBL7027845 0.83 YTHDC1 (0.40) CTSLCTSBPDE10AYTHDC1PDE4A
SCHEMBL1388063 0.83 CTSL (0.42) CTSLYTHDC1
Hydrochloric Acid SCHEMBL7030023 0.82 CTSL (0.41) CTSLYTHDC1
SCHEMBL8393039 0.80 CDK2 (0.39) CTSLPDE10A
SCHEMBL1388327 0.80 MAPK13 (0.34) YTHDC1
Hydrochloric Acid SCHEMBL7028127 0.79 MAPK13 (0.33) YTHDC1
SCHEMBL1388397 0.79 PDE10A (0.43) PDE10AYTHDC1PDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL7030283 0.78 PDE10A (0.42) PDE10AYTHDC1PDE4APDE4BPDE4C

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-0916673-A1 6-Amino purine derivatives having PDE-IV inhibition activity Euroceltique S.A. (LU) 1999-05-19 EP claimed