SCHEMBL4977855

SCHEMBL4977855

COc1cc2cnnc(N3CCC(Nc4ccccn4)CC3)c2cc1OC

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 5/20 0.48
EHMT2 Q96KQ7 11/20 0.46
EHMT1 Q9H9B1 6/20 0.45
KIT P10721 1/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 1/20 0.44
NOS2 P35228 1/20 0.43

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
SCHEMBL4974922 0.88 PDE10A (0.47) PDE10AEHMT2EHMT1LMNAKMT2A
SCHEMBL3042943 0.82 PDE10A (0.53) PDE10APDE3BPDE3ALMNAKMT2A
SCHEMBL11310184 0.81 PDE10A (0.49) PDE10AEHMT2EHMT1LMNAKMT2A
SCHEMBL3059530 0.80 PDE10A (0.48) PDE10AEHMT2EHMT1PDE3BPDE3A
SCHEMBL3059781 0.80 PDE10A (0.52) PDE10APDE3BPDE3ALMNAKMT2A
SCHEMBL3062196 0.78 PDE10A (0.49) PDE10APDE3BPDE3ALMNAKMT2A
SCHEMBL3051634 0.78 PDE10A (0.54) PDE10APDE3BPDE3ALMNAKMT2A
Oxalic Acid SCHEMBL11306727 0.77 PDE10A (0.49) PDE10AEHMT2EHMT1KITLMNA
SCHEMBL3042958 0.77 NTSR1 (0.48) PDE10APDE3BPDE3ALMNAKMT2A
SCHEMBL3056015 0.77 PDE10A (0.56) PDE10APDE3BPDE3ALMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981868-A2 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS Pfizer Products Inc. (US) 2008-10-22 EP claimed
WO-2007085954-A2 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-08-02 WO claimed