SCHEMBL11303232

SCHEMBL11303232

CNC(C)C1CCN(c2nncc3cc(OC)c(OC)cc23)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 5/20 0.46
SOS1 Q07889 5/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
EHMT2 Q96KQ7 4/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
CCR4 P51679 1/20 0.37
EHMT1 Q9H9B1 1/20 0.36

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
SCHEMBL11310184 0.83 PDE10A (0.49) PDE10ASOS1LMNAKMT2AEHMT2
SCHEMBL11307305 0.81 PDE10A (0.59) PDE10ALMNAKMT2APDE4APDE4B
SCHEMBL11177928 0.81 PDE10A (0.47) PDE10ALMNAKMT2AEHMT2PDE4A
SCHEMBL11184509 0.79 CCR4 (0.40) PDE10AKMT2AEHMT2CCR4EHMT1
SCHEMBL3056496 0.79 PDE10A (0.47) PDE10ASOS1LMNAKMT2APDE4A
SCHEMBL11172076 0.79 ENPP1 (0.47) PDE10ALMNAKMT2A
SCHEMBL11309885 0.79 PDE10A (0.48) PDE10ASOS1LMNAKMT2APDE4A
SCHEMBL3059676 0.78 PDE10A (0.55) PDE10ASOS1LMNAKMT2A
Oxalic Acid SCHEMBL11306727 0.78 PDE10A (0.49) PDE10ASOS1LMNAKMT2AEHMT2
Oxalic Acid SCHEMBL11174266 0.77 PDE10A (0.40) PDE10ASOS1EHMT2CCR4EHMT1

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-0017411-B1 PHTHALAZINE CARDIAC STIMULANTS, PROCESSES FOR PREPARING THEM, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Pfizer Limited (GB) 1982-03-31 EP disclosed