SCHEMBL11101040

SCHEMBL11101040

Cc1cc(S)nnc1-c1ccc(-n2ccnc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 1/20 0.57
▸ PDE3A Q14432 1/20 0.57
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ ADH5 P11766 8/20 0.48
▸ MAPT P10636 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ ENPP2 Q13822 1/20 0.44
▸ MKNK1 Q9BUB5 1/20 0.44
▸ MKNK2 Q9HBH9 1/20 0.44
▸ NOTUM Q6P988 1/20 0.44
▸ CYP3A4 P08684 2/20 0.42
▸ BAZ2B Q9UIF8 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ MITF O75030 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL11096275 0.81 PDE3B (0.55) PDE3BPDE3AMEN1KMT2AALOX15
SCHEMBL11096605 0.78 PDE3B (0.52) PDE3BPDE3AMEN1KMT2AALOX15
SCHEMBL11101037 0.78 PDE3B (0.52) PDE3BPDE3AMEN1KMT2AALOX15
SCHEMBL11102889 0.77 PDE3B (0.38) PDE3BPDE3AADH5MAPTLMNA
SCHEMBL11099862 0.76 PDE3B (0.50) PDE3BPDE3AMEN1KMT2AALOX15
SCHEMBL11104830 0.76 PDE3B (0.36) PDE3BPDE3AKMT2AALOX15ADH5
SCHEMBL11099214 0.75 KMT2A (0.49) PDE3BPDE3AMEN1KMT2AALOX15
SCHEMBL11096661 0.75 ADH5 (0.48) PDE3BPDE3AADH5CYP3A4ALDH1A1
SCHEMBL11100354 0.74 PDE3B (0.48) PDE3BPDE3AMEN1KMT2AALOX15
SCHEMBL11099792 0.74 MEN1 (0.54) PDE3BPDE3AMEN1KMT2AALOX15

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-0122419-A2 Substituted 3-mercaptopyridazines, their 3-alkylthio derivatives and processes for their preparation A. Nattermann & Cie. GmbH (DE) 1984-10-24 — — EP disclosed
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