SCHEMBL8660686

SCHEMBL8660686

CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAGI3 Q5TCQ9 1/20 0.50
▸ KMT2A Q03164 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ EDNRA P25101 1/20 0.49
▸ ACE P12821 2/20 0.49
▸ PRMT1 Q99873 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ MPO P05164 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ KISS1R Q969F8 5/20 0.46
▸ ECE1 P42892 3/20 0.46
▸ NPBWR1 P48145 1/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ CASP3 P42574 1/20 0.46

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
SCHEMBL30130527 0.97 MAGI3 (0.54) MAGI3KMT2AL3MBTL1EDNRAACE
SCHEMBL30093012 0.97 MAGI3 (0.54) MAGI3KMT2AL3MBTL1EDNRAACE
SCHEMBL30093068 0.97 MAGI3 (0.54) MAGI3KMT2AL3MBTL1EDNRAACE
SCHEMBL30130582 0.94 EDNRA (0.57) MAGI3EDNRAKISS1R
SCHEMBL30130532 0.92 MAGI3 (0.54) MAGI3KMT2AL3MBTL1EDNRAACE
SCHEMBL30092943 0.92 KISS1R (0.56) MAGI3EDNRAKISS1RECE1
SCHEMBL29989836 0.92 NPBWR1 (0.55) PRMT1KISS1RECE1NPBWR1
SCHEMBL11811768 0.92 MAGI3 (0.54) MAGI3KMT2AL3MBTL1EDNRAACE
SCHEMBL30092978 0.92 EDNRA (0.55) MAGI3KMT2AL3MBTL1EDNRAACE
SCHEMBL30093029 0.92 EDNRA (0.57) MAGI3EDNRAKISS1R

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-5741668-A SYNTHESIZING COELENTERAZINE, A BIOLUMINESCENT COMPOUND RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 1998-04-21 — — US disclosed
WO-1995021191-A1 BIOLUMINESCENT INDICATOR BASED UPON THE EXPRESSION OF A GENE FOR A MODIFIED GREEN-FLUORESCENT PROTEIN WARD WILLIAM (US) 1995-08-10 — — WO disclosed
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