SCHEMBL6812691

SCHEMBL6812691

CC(NC(=O)CN)C(=O)NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 8/20 0.57
▸ ACE P12821 6/20 0.56
▸ CPA1 P15085 5/20 0.56
▸ ACE2 Q9BYF1 5/20 0.56
▸ MMP2 P08253 1/20 0.55
▸ MMP7 P09237 1/20 0.55
▸ MMP9 P14780 1/20 0.55
▸ MMP12 P39900 1/20 0.55
▸ MMP13 P45452 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.52
▸ CTSC P53634 1/20 0.51

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
SCHEMBL6812694 1.00 MME (0.57) MMEACECPA1ACE2MMP2
SCHEMBL30799577 0.90 MME (0.60) MMEMMP2MMP7MMP9MMP12
SCHEMBL29349965 0.89 ACE (0.58) MMEACECPA1ACE2
SCHEMBL21192616 0.89 ACE (0.57) MMEACECPA1ACE2MMP2
SCHEMBL21192611 0.89 ACE (0.57) MMEACECPA1ACE2MMP2
SCHEMBL29603412 0.88 OPRD1 (0.60) MMEACECPA1ACE2
SCHEMBL31064821 0.88 BACE1 (0.51) MMEACECPA1ACE2
SCHEMBL29896984 0.87 MME (0.52) MMEACECPA1ACE2
SCHEMBL8068319 0.87 MME (0.61) MMEACECPA1ACE2NPSR1
SCHEMBL8068326 0.87 MME (0.61) MMEACECPA1ACE2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0803533-B1 Process for the preparation of porous material DAINIPPON INK & CHEMICALS (JP) 2004-02-18 — — EP disclosed
US-6319404-B1 SHAPING SOLUTION OF POLYMERIZABLE CROSSLINKING VINYL MONOMER AND MULTIFUNCTIONAL MONOMER; GELATION; CONTACTING WITH COAGULATION SOLUTION COMPATIBLE WITH SOLVENT; HEAT RESISTANCE, HIGH STRENGTH DAINIPPON INK CHEMICALS, INC. (JP) 2001-11-20 — — US disclosed
EP-0803533-A2 Process for the preparation of porous material DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-10-29 — — EP disclosed
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