SCHEMBL7266830

SCHEMBL7266830

O=CC(CCc1ccccc1)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.51
EPHX1 P07099 2/20 0.46
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
TAAR1 Q96RJ0 1/20 0.43
KEAP1 Q14145 1/20 0.42
ANPEP P15144 2/20 0.42
ERAP1 Q9NZ08 2/20 0.42
ERAP2 Q6P179 1/20 0.42
MME P08473 1/20 0.41
CYP1A2 P05177 3/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HPGD P15428 1/20 0.41
ACP3 P15309 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40

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
SCHEMBL12249323 1.00 ACE (0.51) ACEEPHX1MEN1KMT2ATAAR1
SCHEMBL7319595 0.90 ANPEP (0.46) ACEEPHX1ANPEPERAP1ERAP2
SCHEMBL7266310 0.90 ACE (0.47) ACEMEN1KMT2AKEAP1ANPEP
SCHEMBL7279393 0.89 ACE (0.45) ACEEPHX1SMN1; SMN2SLC6A3MAPK1
SCHEMBL29276444 0.86 SLC6A4 (0.48) ACEMEN1KMT2AMMECYP1A2
SCHEMBL7266299 0.85 EPHX1 (0.54) ACEEPHX1MEN1KMT2ATAAR1
SCHEMBL7266787 0.84 SIGMAR1 (0.48) ACEKMT2ACYP1A2
SCHEMBL19812642 0.82 EPHX1 (0.44) ACEEPHX1MEN1KMT2ATAAR1
SCHEMBL1546515 0.82 TAAR1 (0.46) EPHX1MEN1KMT2ATAAR1SLC6A2
SCHEMBL13443116 0.82 EPHX1 (0.44) ACEEPHX1MEN1KMT2ATAAR1

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4812555-A Peptides possessing renin inhibitory activity MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-03-14 US claimed
US-4755592-A Statine-containing peptides useful in medicaments MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-07-05 US claimed
US-4721776-A Amino acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-01-26 US claimed
EP-0264106-B1 5-Substituted amino-4-hydroxy-pentanoic acid derivatives and their use BANYU PHARMA CO LTD (JP) 1994-03-16 EP disclosed
EP-0272583-B1 5-SUBSTITUTED AMINO-4-HYDROXY-PENTENOIC ACID DERIVATIVES AND THEIR USE Banyu Pharmaceutical Co., Ltd. (JP) 1993-09-15 EP disclosed
EP-0198271-B1 PEPTIDES MERCK PATENT GmbH (DE) 1993-06-09 EP disclosed
US-4927565-A HYPOTENSIVE AGENT BANYU PHARMACEUTICAL CO., LTD. (JP) 1990-05-22 US disclosed
EP-0327877-A2 Peptide-renininhibitors MERCK PATENT GmbH (DE) 1989-08-16 EP disclosed
US-4851387-A RENIN INHIBITORS BANYU PHARMACEUTICAL CO., LTD. (JP) 1989-07-25 US disclosed
US-4829053-A Amino acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-05-09 US disclosed
EP-0309841-A2 Amino acid derivatives MERCK PATENT GmbH (DE) 1989-04-05 EP disclosed
EP-0272444-A2 Renin-inhibiting peptides MERCK PATENT GmbH (DE) 1988-06-29 EP disclosed
EP-0264795-A2 Amino acid derivatives MERCK PATENT GmbH (DE) 1988-04-27 EP disclosed
EP-0264106-A2 5-Substituted amino-4-hydroxy-pentanoic acid derivatives and their use Banyu Pharmaceutical Co., Ltd. (JP) 1988-04-20 EP disclosed
EP-0262318-A2 Renin-inhibiting amino acid derivatives MERCK PATENT GmbH (DE) 1988-04-06 EP disclosed
US-4721776-A Amino acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-01-26 US disclosed
EP-0249096-A2 Renin-inhibiting amino acid derivatives MERCK PATENT GmbH (DE) 1987-12-16 EP disclosed
EP-0222283-A2 Amino-acid derivatives MERCK PATENT GmbH (DE) 1987-05-20 EP disclosed
EP-0220665-A2 Peptides MERCK PATENT GmbH (DE) 1987-05-06 EP disclosed
EP-0198271-A2 Peptides MERCK PATENT GmbH (DE) 1986-10-22 EP disclosed