SCHEMBL7336427

SCHEMBL7336427

CC(C)C[C@H](NC(=O)C(Cc1ccccc1)CS(=O)(=O)N1CCNCC1)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FCER2 P06734 2/20 0.49
▸ MMP1 P03956 1/20 0.49
▸ MME P08473 1/20 0.48
▸ ERAP2 Q6P179 5/20 0.47
▸ ERAP1 Q9NZ08 5/20 0.47
▸ LNPEP Q9UIQ6 5/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ REN P00797 2/20 0.44
▸ PTPN1 P18031 1/20 0.44

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
SCHEMBL7329490 0.89 REN (0.54) FCER2MMP1MMEERAP2ERAP1
SCHEMBL7330912 0.89 REN (0.54) FCER2MMP1MMEERAP2ERAP1
SCHEMBL7334299 0.88 MME (0.47) FCER2MMP1MMEERAP2ERAP1
SCHEMBL7329495 0.86 LTA4H (0.48) MMEKMT2A
SCHEMBL7328611 0.86 REN (0.53) FCER2MMP1MMEERAP2ERAP1
SCHEMBL7336719 0.86 FCER2 (0.47) FCER2MMP1MMEERAP2ERAP1
SCHEMBL7331751 0.83 REN (0.54) FCER2MMP1RENPTPN1
SCHEMBL9556647 0.80 FCER2 (0.67) FCER2MMP1MMEERAP2ERAP1
SCHEMBL7353235 0.77 REN (0.47) MMEERAP2ERAP1LNPEPREN
Hydrochloric Acid SCHEMBL7338311 0.76 KMT2A (0.55) KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5332742-A Ocular hypotensive ABBOTT LABORATORIES (US) 1994-07-26 — — US disclosed
US-5310740-A Congestive heart failure, hypotensive agents, antiglaucoma agents; side effect reduction ABBOTT LABORATORIES (US) 1994-05-10 — — US disclosed
US-5284849-A Treating hypertension and congestive heart failure ABBOTT LABORATORIES (US) 1994-02-08 — — US disclosed
EP-0456185-A2 Renin inhibitors ABBOTT LABORATORIES (US) 1991-11-13 — — EP disclosed
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