SCHEMBL10519857

SCHEMBL10519857

CC1CC(=O)NN=C1c1ccc2[nH]c(N3CCSCC3)nc2c1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 7/20 0.62
▸ PDE3B Q13370 11/20 0.48
▸ PDE3A Q14432 11/20 0.48
▸ F10 P00742 1/20 0.48
▸ ABCB11 O95342 1/20 0.48
▸ MAOA P21397 1/20 0.48
▸ ADORA2A P29274 1/20 0.48
▸ PDE4A P27815 1/20 0.47
▸ PDE4B Q07343 1/20 0.47
▸ PDE4C Q08493 1/20 0.47
▸ PDE4D Q08499 1/20 0.47

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
SCHEMBL10517959 0.91 GPR119 (0.59) GPR119PDE3BPDE3AF10ABCB11
SCHEMBL10518157 0.90 GPR119 (0.61) GPR119PDE3BPDE3AF10ABCB11
SCHEMBL10519085 0.90 GPR119 (0.61) GPR119PDE3BPDE3AF10ABCB11
SCHEMBL10518681 0.89 PDE3B (0.62) GPR119PDE3BPDE3AF10ABCB11
SCHEMBL10518321 0.88 PDE3B (0.64) GPR119PDE3BPDE3AABCB11MAOA
SCHEMBL10518148 0.86 GPR119 (0.48) GPR119PDE3BPDE3AF10ABCB11
SCHEMBL10517762 0.85 GPR119 (0.51) GPR119PDE3BPDE3AF10ABCB11
SCHEMBL10518942 0.82 PDE3B (0.50) GPR119PDE3BPDE3AF10ABCB11
SCHEMBL10517966 0.82 GPR119 (0.62) GPR119PDE3BPDE3AF10ABCB11
SCHEMBL10519090 0.81 GPR119 (0.64) GPR119PDE3BPDE3AF10ABCB11

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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