SCHEMBL10726946

SCHEMBL10726946

Cc1nccn1-c1ccc(C2=NNC(=O)CC2)s1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 11/20 0.61
▸ PDE3A Q14432 11/20 0.61
▸ PDE2A O00408 3/20 0.38
▸ PDE1A P54750 1/20 0.38
▸ PDE1B Q01064 1/20 0.38
▸ PDE1C Q14123 1/20 0.38
▸ PDE4B Q07343 4/20 0.38
▸ PDE4A P27815 3/20 0.38
▸ PDE4C Q08493 3/20 0.38
▸ PDE4D Q08499 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ MGAM O43451 1/20 0.36

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
SCHEMBL11020516 0.78 PDE3B (0.49) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10650666 0.78 PDE3B (0.49) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10647873 0.78 PBRM1 (0.48) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL11020513 0.78 PDE3B (0.49) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL7280962 0.76 PDE3B (1.00) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10724467 0.76 PDE3B (0.47) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL13464716 0.75 SMN1; SMN2 (0.50) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10648314 0.75 PDE3B (0.60) PDE3BPDE3APDE2APDE4BPDE4A
SCHEMBL10806820 0.74 PDE3B (0.46) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10726907 0.74 PDE3B (0.45) PDE3BPDE3APDE2APDE1APDE1B

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-0112987-B1 IMIDAZOLYLALKYLTHIENYL-TETRAHYDROPYRIDAZINES AND PROCESS FOR THEIR PREPARATION A. Nattermann & Cie. GmbH (DE) 1987-04-01 — — EP disclosed
US-4643998-A Imidazolylalkylthienyl tetrahydropyridazines and processes for their use A. NATTERMAN & CIE GMBH (DE) 1987-02-17 — — US disclosed
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