SCHEMBL7430633

SCHEMBL7430633

CCCCc1[nH]c(=O)[nH]c1C(=O)c1cc(SC)ccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.41
PDE3A Q14432 3/20 0.41
PDE4A P27815 14/20 0.39
PDE4B Q07343 14/20 0.39
PDE4C Q08493 14/20 0.39
PDE4D Q08499 14/20 0.39
NPSR1 Q6W5P4 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
ATM Q13315 1/20 0.39
HSD17B10 Q99714 1/20 0.39
POLB P06746 1/20 0.36
GSK3B P49841 1/20 0.34

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
SCHEMBL9787196 0.88 L3MBTL1 (0.32) NPSR1CYP1A2CYP3A4ALOX15TSHR
SCHEMBL10502059 0.80 POLB (0.46) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10864124 0.73 PDE3B (0.74) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7434015 0.71 PDE3B (0.56) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7440527 0.68 NFKB1 (0.56) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7434326 0.68 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7436736 0.68 PDE3B (0.51) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7440629 0.66 PDE3B (0.59) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10635478 0.65 PDE3B (0.65) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL8328740 0.65 ALDH1A1 (0.55) CYP1A2HSD17B10POLBHCAR2SMN1; SMN2

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
US-4405628-A 4-Pyridylimidazolones and method of use MERRELL DOW PHARMACEUTICALS INC. (US) 1983-09-20 US disclosed
EP-0059948-A1 Novel aroylimidazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1982-09-15 EP disclosed