SCHEMBL29682736

SCHEMBL29682736

NC(=O)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)C(=O)NCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.44
PTGS1 P23219 1/20 0.43
GSTK1 Q9Y2Q3 1/20 0.43
PDCD1LG2 Q9BQ51 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
EGFR P00533 1/20 0.40
BACE1 P56817 6/20 0.39
CTSD P07339 2/20 0.39
BMP1 P13497 3/20 0.38
DPP4 P27487 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37

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
SCHEMBL29630745 0.96 GLO1 (0.43) GLO1PTGS1GSTK1PDCD1LG2CD274
SCHEMBL30099639 0.94 GLO1 (0.41) GLO1PTGS1GSTK1PDCD1LG2CD274
SCHEMBL30069089 0.93 GLO1 (0.44) GLO1PTGS1GSTK1PDCD1LG2CD274
SCHEMBL29693286 0.92 GLO1 (0.49) GLO1PTGS1GSTK1EGFRBMP1
SCHEMBL30612515 0.92 PDCD1LG2 (0.47) GLO1PTGS1GSTK1PDCD1LG2CD274
SCHEMBL29644351 0.91 PDCD1LG2 (0.44) GLO1PTGS1GSTK1PDCD1LG2CD274
SCHEMBL29744873 0.91 PDCD1LG2 (0.44) GLO1PTGS1GSTK1PDCD1LG2CD274
SCHEMBL30974035 0.91 GLO1 (0.46) GLO1PTGS1GSTK1EGFRBMP1
SCHEMBL29940990 0.89 GLO1 (0.47) GLO1PTGS1GSTK1EGFRBACE1
SCHEMBL31571920 0.87 PTGS1 (0.59) GLO1PTGS1GSTK1EGFRBMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220135953-A1 BIOFUNCTIONALIZED HYDROGEL FOR CELL CULTURE VANDERBILT UNIVERSITY 2022-05-05 US claimed
US-20240050627-A1 CLASS OF BIOMATERIALS FOR PROMOTING LARGE BLOOD VESSEL GROWTH VANDERBILT UNIVERSITY 2024-02-15 US disclosed
EP-4262752-A1 CLASS OF BIOMATERIALS FOR PROMOTING LARGE BLOOD VESSEL GROWTH Vanderbilt University (US) 2023-10-25 EP disclosed
WO-2022133309-A1 CLASS OF BIOMATERIALS FOR PROMOTING LARGE BLOOD VESSEL GROWTH VANDERBILT UNIVERSITY (US) 2022-06-23 WO disclosed
US-20220135953-A1 BIOFUNCTIONALIZED HYDROGEL FOR CELL CULTURE VANDERBILT UNIVERSITY 2022-05-05 US disclosed