SCHEMBL10365506

SCHEMBL10365506

CC1=C(c2ccc(-n3ccnc3)s2)CC(C)C(=O)N1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 10/20 0.47
▸ PDE3A Q14432 10/20 0.47
▸ PDE2A O00408 2/20 0.47
▸ PDE1A P54750 1/20 0.47
▸ PDE1B Q01064 1/20 0.47
▸ PDE1C Q14123 1/20 0.47
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE4D Q08499 1/20 0.38
▸ BRD4 O60885 1/20 0.31
▸ CREBBP Q92793 1/20 0.31
▸ CRBN Q96SW2 3/20 0.31
▸ TBXAS1 P24557 1/20 0.31
▸ CYP19A1 P11511 2/20 0.30

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
Hydrochloric Acid SCHEMBL10366391 0.99 PDE3B (0.46) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10364522 0.86 PDE3B (0.40) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10365668 0.80 PDE3B (0.43) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10363627 0.80 PDE3B (0.42) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10364636 0.79 PDE3B (0.48) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10651787 0.78 PDE3B (0.63) PDE3BPDE3APDE2APDE1APDE1B
Hydrochloric Acid SCHEMBL10367316 0.78 PDE3B (0.47) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10761383 0.78 PDE3B (0.73) PDE3BPDE3APDE2APDE1APDE1B
Hydrochloric Acid SCHEMBL10757069 0.77 PDE3B (0.72) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10646114 0.74 PDE3A (0.63) PDE3BPDE3APDE2APDE4APDE4B

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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