SCHEMBL7290086

SCHEMBL7290086

CCN(CC)C(=O)C[C@@H](Cc1cccc2ccccc12)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.48
▸ CTNNB1 P35222 1/20 0.48
▸ PSMB8 P28062 2/20 0.46
▸ PSMB5 P28074 2/20 0.46
▸ MME P08473 2/20 0.46
▸ ACE P12821 2/20 0.46
▸ CPA1 P15085 1/20 0.46
▸ ACE2 Q9BYF1 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ HRH4 Q9H3N8 1/20 0.44
▸ HTR2A P28223 8/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ CHRM2 P08172 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ DRD1 P21728 1/20 0.41

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
SCHEMBL10756689 0.86 CTNNB1 (0.50) CTNNB1MMEACECPA1ACE2
SCHEMBL10477757 0.86 CTNNB1 (0.47) CTNNB1MMEACECPA1ACE2
SCHEMBL9194477 0.82 CPA1 (0.57) CTNNB1MMEACECPA1ACE2
SCHEMBL10338654 0.82 CPA1 (0.57) CTNNB1MMEACECPA1ACE2
SCHEMBL3814684 0.82 CTNNB1 (0.56) CTNNB1MMEACECPA1ACE2
SCHEMBL7429100 0.82 CPA1 (0.57) CTNNB1MMEACECPA1ACE2
SCHEMBL9554930 0.82 MME (0.48) CTNNB1MMEACECPA1ACE2
SCHEMBL9554924 0.82 MME (0.48) CTNNB1MMEACECPA1ACE2
SCHEMBL6677809 0.81 CTNNB1 (0.63) CTNNB1MMEACECPA1ACE2
SCHEMBL7310334 0.81 NPC1 (0.48) CTNNB1TDP1HRH4MEN1KMT2A

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-5378690-A Treatment of angiotensin induced hypertension SANKYO COMPANY, LIMITED (JP) 1995-01-03 — — US disclosed
EP-0274259-A2 New renin-inhibitory oligopeptides, their preparaton and their use Sankyo Company Limited (JP) 1988-07-13 — — EP disclosed
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