SCHEMBL27518751

SCHEMBL27518751

[CH2]c1ccc2c(OC)c(OC)c(OC)cc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.46
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
PDGFRB P09619 1/20 0.43
PDGFRA P16234 1/20 0.43
KDM4E B2RXH2 1/20 0.42
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42
TUBB3 Q13509 1/20 0.42
TUBB2A Q13885 1/20 0.42
TUBB8 Q3ZCM7 1/20 0.42
TUBA3E Q6PEY2 1/20 0.42
TUBA1A Q71U36 1/20 0.42
TUBA1C Q9BQE3 1/20 0.42
TUBB6 Q9BUF5 1/20 0.42
TUBB2B Q9BVA1 1/20 0.42

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
SCHEMBL2909338 0.81 MAOA (0.47) MAOAPDE3BPDE3APDGFRBPDGFRA
SCHEMBL1337795 0.79 MAOA (0.46) MAOAPDE3BPDE3APDGFRBPDGFRA
SCHEMBL7837160 0.77 PDE3A (0.47) MAOAPDE3BPDE3APDGFRBPDGFRA
SCHEMBL2907694 0.76 MAOA (0.43) MAOAPDE3BPDE3APDGFRBPDGFRA
SCHEMBL1337297 0.76 PDE3B (0.46) MAOAPDE3BPDE3APDGFRBPDGFRA
SCHEMBL2905838 0.76 MAOA (0.43) MAOAPDE3BPDE3APDGFRBPDGFRA
SCHEMBL28231525 0.74 ALOX15 (0.54) MAOAPDE3BPDE3AKDM4E
SCHEMBL2639183 0.74 PDGFRB (0.52) PDE3BPDE3APDGFRBPDGFRAKDM4E
SCHEMBL27545732 0.74 MAOA (0.44) MAOAKDM4ETUBB4ATUBBTUBA3C
SCHEMBL13870932 0.73 MAOA (0.44) MAOAPDE3BPDE3APDGFRBPDGFRA

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
CN-1281585-C Cyclic diamine compounds having fused-ring groups KOWA CO (JP) 2006-10-25 CN disclosed
CN-1599717-A Cyclic diamine compounds having fused-ring groups KOWA CO (JP) 2005-03-23 CN disclosed