SCHEMBL10364014

SCHEMBL10364014

CCC1=C(c2cc(-n3ccnc3)cs2)CCC(=O)N1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 10/20 0.45
▸ PDE3A Q14432 10/20 0.45
▸ CRBN Q96SW2 3/20 0.45
▸ TBXAS1 P24557 1/20 0.45
▸ PDE4A P27815 5/20 0.37
▸ PDE4B Q07343 5/20 0.37
▸ PDE4C Q08493 5/20 0.37
▸ PDE4D Q08499 5/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ PDE2A O00408 2/20 0.35
▸ TNIK Q9UKE5 1/20 0.35
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33

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
SCHEMBL10363996 0.85 PDE3B (0.47) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL10364002 0.82 PDE3B (0.42) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL10363621 0.80 PDE3B (0.41) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL10757305 0.79 PDE3B (0.54) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL10648101 0.73 PDE3B (0.62) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL10364636 0.71 PDE3B (0.48) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL7340691 0.71 PDE3B (0.51) PDE3BPDE3ACRBNTBXAS1PDE4A
Hydrochloric Acid SCHEMBL10367316 0.70 PDE3B (0.47) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL10365680 0.70 PDE4A (0.43) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10730608 0.70 PDE3B (0.67) PDE3BPDE3ACRBNPDE4APDE4B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0175187-B1 3,4-DIHYDRO-2(1H)-PYRIDONES AND 2(1H)-PYRIDONES CONTAINING IMIDAZOLE GROUPS, METHOD FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM A. Nattermann & Cie. GmbH (DE) 1990-01-10 — — EP disclosed
US-4699914-A CONGESTIVE HEART FAILURE A. NATTERMANN & CIE GMBH (DE) 1987-10-13 — — US disclosed
EP-0175187-A1 3,4-Dihydro-2(1H)-pyridones and 2(1H)-pyridones containing imidazole groups, method for their preparation and medicaments containing them A. Nattermann & Cie. GmbH (DE) 1986-03-26 — — EP disclosed
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