SCHEMBL9223003

SCHEMBL9223003

CCCCc1cc(C(=O)OC)cc(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cn1

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.39

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
SCHEMBL8829804 0.91 AGTR1 (0.44) AGTR1
SCHEMBL8894371 0.90
Potassium SCHEMBL8886365 0.89
SCHEMBL8886994 0.89
SCHEMBL8886997 0.89
SCHEMBL8829800 0.88 AGTR1 (0.36) AGTR1
SCHEMBL8009750 0.86
SCHEMBL8013981 0.86 AGTR1 (0.39) AGTR1
Embusartan SCHEMBL29409583 0.86 BDKRB1 (0.41) AGTR1
Embusartan SCHEMBL167147 0.86 BDKRB1 (0.41) AGTR1

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-5407948-A For treating hypertension, atherosclerosis BAYER AKTIENGESELLSCHAFT (DE) 1995-04-18 US claimed
US-5407948-A For treating hypertension, atherosclerosis BAYER AKTIENGESELLSCHAFT (DE) 1995-04-18 US disclosed