SCHEMBL10519090

SCHEMBL10519090

CC1CC(=O)NN=C1c1ccc2nc(N3CCCCCC3)[nH]c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 9/20 0.64
▸ PDE3B Q13370 7/20 0.59
▸ PDE3A Q14432 7/20 0.59
▸ ABCB11 O95342 1/20 0.59
▸ MAOA P21397 1/20 0.59
▸ ADORA2A P29274 1/20 0.59
▸ F10 P00742 1/20 0.56
▸ NPC1 O15118 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ GFER P55789 1/20 0.49
▸ NFKB2 Q00653 1/20 0.49
▸ RELA Q04206 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ PDE4A P27815 1/20 0.48
▸ PDE4B Q07343 1/20 0.48
▸ PDE4C Q08493 1/20 0.48

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
SCHEMBL10517966 0.99 GPR119 (0.62) GPR119PDE3BPDE3AABCB11MAOA
SCHEMBL10519085 0.92 GPR119 (0.61) GPR119PDE3BPDE3AABCB11MAOA
SCHEMBL10518157 0.92 GPR119 (0.61) GPR119PDE3BPDE3AABCB11MAOA
SCHEMBL10518697 0.91 PDE3B (0.62) GPR119PDE3BPDE3AABCB11MAOA
SCHEMBL10517959 0.90 GPR119 (0.59) GPR119PDE3BPDE3AABCB11MAOA
SCHEMBL10517769 0.87 PDE3B (0.55) GPR119PDE3BPDE3AABCB11MAOA
SCHEMBL10518681 0.82 PDE3B (0.62) GPR119PDE3BPDE3AABCB11MAOA
SCHEMBL10518321 0.81 PDE3B (0.64) GPR119PDE3BPDE3AABCB11MAOA
SCHEMBL10519857 0.81 GPR119 (0.62) GPR119PDE3BPDE3AABCB11MAOA
SCHEMBL28644807 0.81 PDE3B (0.67) GPR119PDE3BPDE3AABCB11MAOA

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-0196005-B1 PYRIDAZINONES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Karl Thomae GmbH (DE) 1989-12-20 — — EP disclosed
EP-0196005-A1 Pyridazinones, their preparation and pharmaceutical compositions containing them Dr. Karl Thomae GmbH (DE) 1986-10-01 — — EP disclosed
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