SCHEMBL29868562

SCHEMBL29868562

CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 6/20 0.49
▸ TGFBR1 P36897 3/20 0.49
▸ DPP4 P27487 2/20 0.46
▸ DPP8 Q6V1X1 2/20 0.46
▸ DPP9 Q86TI2 2/20 0.46
▸ DPP7 Q9UHL4 2/20 0.46
▸ FAP Q12884 1/20 0.46
▸ SLC7A5 Q01650 1/20 0.43
▸ ECE1 P42892 2/20 0.41
▸ ACE P12821 1/20 0.41
▸ CA2 P00918 2/20 0.36
▸ CA1 P00915 1/20 0.36

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
SCHEMBL29590449 1.00 MME (0.49) MMETGFBR1DPP4DPP8DPP9
SCHEMBL29696989 1.00 MME (0.49) MMETGFBR1DPP4DPP8DPP9
SCHEMBL29630533 1.00 MME (0.49) MMETGFBR1DPP4DPP8DPP9
SCHEMBL6674368 0.96 TGFBR1 (0.52) MMETGFBR1DPP4DPP8DPP9
SCHEMBL28124001 0.96 TGFBR1 (0.52) MMETGFBR1DPP4DPP8DPP9
SCHEMBL31630525 0.90 MME (0.55) MMETGFBR1DPP4DPP8DPP9
SCHEMBL3289560 0.90 MME (0.55) MMETGFBR1DPP4DPP8DPP9
SCHEMBL3289576 0.90 MME (0.55) MMETGFBR1DPP4DPP8DPP9
SCHEMBL30930167 0.90 MME (0.51) MMEDPP4DPP8DPP9DPP7
SCHEMBL29462928 0.90 DPP4 (0.43) MMETGFBR1DPP4DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116948034-B Active type heterophagy antibody blocker Block-5S and preparation method thereof 南京珀尔泰生物技术有限公司 2024-06-25 — — CN disclosed
US-20240141305-A1 HSD17B13 VARIANTS AND USES THEREOF REGENERON PHARMACEUTICALS, INC. 2024-05-02 — — US disclosed
US-11845963-B2 HSD17B13 variants and uses thereof REGENERON PHARMACEUTICALS, INC. (US) 2023-12-19 — — US disclosed
CN-116948034-A Active type heterophagy antibody blocker Block-5S and preparation method thereof 南京珀尔泰生物技术有限公司 2023-10-27 — — CN disclosed
US-11753628-B2 HSD17B13 variants and uses thereof REGENERON PHARMACEUTICALS, INC. (US) 2023-09-12 — — US disclosed
CN-110003336-B PD-1 single domain antibody, nucleotide sequence and kit 深圳普瑞金生物药业股份有限公司 2023-05-12 — — CN disclosed
WO-2022272026-A1 METHODS AND COMPOSITIONS RELATING TO TISSUE-PROTECTIVE ERYTHROPOIETIN PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2022-12-29 — — WO disclosed
US-20220267743-A1 HSD17B13 Variants And Uses Thereof REGENERON PHARMACEUTICALS, INC. 2022-08-25 — — US disclosed
Send feedback