SCHEMBL7657698

SCHEMBL7657698

CCCCc1nnc(C(c2ccncc2)c2ccc(-c3ccccc3/C=C3\NC(=O)CC3=O)cc2)[nH]1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.32
BRS3 P32247 1/20 0.31

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
SCHEMBL7657432 0.94 BRS3 (0.34) BRS3
SCHEMBL7653995 0.92 BRS3 (0.31) BRS3
SCHEMBL7661069 0.89
SCHEMBL7924096 0.88
SCHEMBL7657379 0.88 APLNR (0.31)
SCHEMBL7654413 0.86 BRS3 (0.32) BRS3
SCHEMBL7658315 0.85 GSK3B (0.31) GSK3B
SCHEMBL7924639 0.84 BRS3 (0.30) BRS3
SCHEMBL7650688 0.79 AGTR1 (0.32) BRS3
SCHEMBL7660666 0.79 BRS3 (0.32) GSK3BBRS3

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