SCHEMBL7654064

SCHEMBL7654064

CCCCc1nc(C(c2ccc(-c3ccccc3/C=C3\OC(=O)C=C3O)cc2)C2CC2)n[nH]1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
APLNR P35414 4/20 0.33
AGTR2 P50052 1/20 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
SCHEMBL7653334 0.87 AGTR1 (0.33) AGTR2
SCHEMBL7658574 0.87 APLNR (0.32) APLNR
SCHEMBL7657701 0.85 GSK3B (0.30) AGTR2
SCHEMBL7650730 0.85 APLNR (0.34) APLNRAGTR2
SCHEMBL7657438 0.85 BRS3 (0.34) AGTR2
SCHEMBL7654688 0.84
SCHEMBL7924623 0.84 DDX3X (0.33)
SCHEMBL7652695 0.83
SCHEMBL7655666 0.82 APLNR (0.35) APLNR
SCHEMBL7660683 0.80 APLNR (0.31) APLNR

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-6358984-B1 FOR THERAPY OF HYPERTENSION AND/OR DISEASES SUCH AS HEART AND RENAL DISEASES LEAD CHEMICAL CO., LTD. (JP) 2002-03-19 US disclosed
US-6232335-B1 A BIPHENYL TRIAZOLE COMPOUND USEFUL AS A ANGIOTENSIN II CONVERTING ENZYME INHIBITORS EFFECTIVE IN THE TREATMENT OF HYPERTENSION OR HEART FAILURE LEAD CHEMICAL CO., LTD. (JP) 2001-05-15 US disclosed