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Sugi Predict / Compounds / SCHEMBL29697094

SCHEMBL29697094

SCHEMBL29697094

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 4/20 0.59
▸ OPRM1 P35372 1/20 0.57
▸ OPRD1 P41143 1/20 0.57
▸ GLP1R P43220 8/20 0.57
▸ GIPR P48546 6/20 0.57
▸ TFPI P10646 2/20 0.56
▸ NPY1R P25929 1/20 0.55
▸ NPY2R P49146 1/20 0.55
▸ NPY4R P50391 1/20 0.55
▸ NPY5R Q15761 1/20 0.55
▸ CCKBR P32239 2/20 0.55

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
SCHEMBL30567693 0.92 GLP1R (0.55) CALCROPRM1OPRD1GLP1RGIPR
SCHEMBL31000913 0.90 CALCR (0.66) CALCROPRM1OPRD1GLP1RGIPR
SCHEMBL31656525 0.89 GLP1R (0.56) CALCROPRM1OPRD1GLP1RGIPR
SCHEMBL30607299 0.88 CALCR (0.57) CALCROPRM1OPRD1GLP1RGIPR
SCHEMBL29939144 0.87 NPY2R (0.58) CALCRTFPINPY1RNPY2RNPY4R
SCHEMBL31005079 0.87 TFPI (0.67) CALCROPRM1OPRD1TFPINPY1R
SCHEMBL30433441 0.87 CALCR (0.65) CALCROPRD1GLP1RGIPRNPY1R
SCHEMBL31388233 0.87 KEAP1 (0.60) CALCROPRM1OPRD1
SCHEMBL30726589 0.86 CRHR1 (0.57) CALCROPRM1OPRD1GLP1RGIPR
SCHEMBL30906419 0.86 CALCR (0.65) CALCROPRM1OPRD1TFPINPY1R

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-11851664-B2 Methods for producing biochemicals using enzyme genes derived from a strain of Brevundimonas, and compositions made thereby Oakbio, Inc. (US) 2023-12-26 — — US disclosed
EP-4267551-A1 METHODS FOR PRODUCING BIOCHEMICALS USING ENZYME GENES DERIVED FROM A STRAIN OF BREVUNDIMONAS, AND COMPOSITIONS MADE THEREBY Oakbio Inc. (US) 2023-11-01 — — EP disclosed
WO-2022140493-A1 METHODS FOR PRODUCING BIOCHEMICALS USING ENZYME GENES DERIVED FROM A STRAIN OF BREVUNDIMONAS, AND COMPOSITIONS MADE THEREBY Oakbio, Inc. (US) 2022-06-30 — — WO disclosed
US-20220204979-A1 METHODS FOR PRODUCING BIOCHEMICALS USING ENZYME GENES DERIVED FROM A STRAIN OF BREVUNDIMONAS, AND COMPOSITIONS MADE THEREBY ARCOLOGY INC. (DBA BIOSPHERE) 2022-06-30 — — US disclosed
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