SCHEMBL8913133

SCHEMBL8913133

CCCCc1nc2cccnc2n1Cc1ccc2nc(-c3ccccc3C(=O)OC)ccc2c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
ENPP2 Q13822 1/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
AGTR1 P30556 3/20 0.48
AGTR2 P50052 3/20 0.48
LMNA P02545 2/20 0.47
GAA P10253 1/20 0.46

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
SCHEMBL9235936 0.91 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9096716 0.90 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL9093654 0.89 AGTR1 (0.49) ALDH1A1ENPP2AGTR1AGTR2LMNA
SCHEMBL7850720 0.87 AGTR1 (0.62) ALDH1A1ENPP2AGTR1AGTR2
SCHEMBL9571416 0.84 ALDH1A1 (0.49) ALDH1A1ENPP2MEN1KMT2AAGTR1
SCHEMBL8914300 0.83 AGTR2 (0.64) AGTR1AGTR2
SCHEMBL8719876 0.82 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL7853305 0.81 AGTR1 (0.59) ALDH1A1ENPP2MEN1KMT2AAGTR1
SCHEMBL9242034 0.81 AGTR1 (0.47) ALDH1A1ENPP2AGTR1AGTR2
SCHEMBL9093282 0.79 AGTR1 (0.54) ALDH1A1ENPP2MEN1KMT2AAGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5665881-A CARDIOVASCULAR DISORDERS, HYPOTENSIVE, ANGIOTENSIN II ANTAGONIST THE GREEN CROSS CORPORATION (JP) 1997-09-09 US disclosed
EP-0569013-B1 Quinoline compounds as angiotensin II antagonists GREEN CROSS CORP (JP) 1996-08-28 EP disclosed
EP-0693478-A1 Quinoline compounds THE GREEN CROSS CORPORATION (JP) 1996-01-24 EP disclosed
US-5478832-A Angiotensin II antagonists; cardiovascular disorders THE GREEN CROSS CORPORATION (JP) 1995-12-26 US disclosed
EP-0569013-A1 Quinoline compounds as angiotensin II antagonists THE GREEN CROSS CORPORATION (JP) 1993-11-10 EP disclosed