SCHEMBL9257585

SCHEMBL9257585

CCCC1=NC(=O)C(C2CC2)(C2CC2)N1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.41
LTB4R2 Q9NPC1 2/20 0.40
AGTR2 P50052 2/20 0.40
ABCC3 O15438 1/20 0.40
ABCC4 O15439 1/20 0.40
ABCB11 O95342 1/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
GAA P10253 1/20 0.40
EDNRA P25101 1/20 0.40
MAPK1 P28482 1/20 0.40
HTR2B P41595 1/20 0.40
PDE3A Q14432 1/20 0.40
SLC10A1 Q14973 1/20 0.40

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
SCHEMBL9252048 0.86 AGTR1 (0.41) AGTR1LTB4R2AGTR2
SCHEMBL9541024 0.85 AGTR1 (0.47) AGTR1LTB4R2AGTR2ABCC3ABCC4
SCHEMBL9257314 0.83 AGTR1 (0.40) AGTR1LTB4R2AGTR2ABCC3ABCC4
SCHEMBL9248296 0.83 AGTR1 (0.48) AGTR1LTB4R2AGTR2ABCC3ABCC4
SCHEMBL9671801 0.77 AGTR1 (0.64) AGTR1LTB4R2AGTR2ABCC3ABCC4
SCHEMBL9672263 0.76 AGTR1 (0.51) AGTR1LTB4R2AGTR2ABCC3ABCC4
SCHEMBL683434 0.76 AGTR1 (0.66) AGTR1LTB4R2AGTR2ABCC3ABCC4
SCHEMBL8702000 0.75 AGTR1 (0.47) AGTR1LTB4R2AGTR2ABCC3ABCC4
SCHEMBL8958378 0.75 AGTR1 (0.54) AGTR1LTB4R2AGTR2ABCC3ABCC4
SCHEMBL8958364 0.75 AGTR1 (0.54) AGTR1LTB4R2AGTR2ABCC3ABCC4

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-0599999-A1 ANGIOTENSIN II RECEPTOR BLOCKING IMIDAZOLINONE DERIVATIVES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-06-08 EP claimed
US-5424450-A Angiotensin II receptor blocking imidazolinone derivatives E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-06-13 US disclosed
EP-0599999-A1 ANGIOTENSIN II RECEPTOR BLOCKING IMIDAZOLINONE DERIVATIVES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-06-08 EP disclosed