SCHEMBL29919341

SCHEMBL29919341

NC(N)=NCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNPAT O15228 1/20 0.51
▸ C3AR1 Q16581 3/20 0.50
▸ CYP1A2 P05177 1/20 0.49
▸ GLA P06280 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ APEX1 P27695 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ NOS2 P35228 1/20 0.49
▸ NPY1R P25929 3/20 0.48
▸ NPY2R P49146 1/20 0.48
▸ NPY4R P50391 1/20 0.48
▸ EPHX2 P34913 1/20 0.47
▸ SLC6A5 Q9Y345 1/20 0.46
▸ SIRT5 Q9NXA8 1/20 0.45
▸ CHRM2 P08172 2/20 0.45
▸ CHRM4 P08173 2/20 0.45
▸ CHRM1 P11229 2/20 0.45
▸ EGFR P00533 1/20 0.45
▸ CA2 P00918 1/20 0.44

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
SCHEMBL31110298 0.95 C3AR1 (0.54) C3AR1CYP1A2GLATSHRNFKB1
SCHEMBL31110300 0.95 C3AR1 (0.54) C3AR1CYP1A2GLATSHRNFKB1
SCHEMBL29566514 0.94 NPY1R (0.52) C3AR1CYP1A2GLATSHRNFKB1
SCHEMBL29794337 0.91 CYP2C19 (0.56) GNPATC3AR1CYP1A2GLATSHR
SCHEMBL1736266 0.90 NPY1R (0.55) GNPATC3AR1CYP1A2GLATSHR
SCHEMBL29611117 0.90 CYP2C19 (0.58) C3AR1CYP1A2GLATSHRNFKB1
SCHEMBL29613341 0.88 CYP2C19 (0.59) GNPATC3AR1CYP1A2GLATSHR
SCHEMBL1736416 0.88 CYP2C19 (0.59) GNPATC3AR1CYP1A2GLATSHR
SCHEMBL1736042 0.88 CYP2C19 (0.59) GNPATC3AR1CYP1A2GLATSHR
SCHEMBL29355798 0.87 NPY1R (0.51) GNPATC3AR1CYP1A2GLATSHR

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-20250360156-A1 SYNERGISTIC COMBINATION OF NAD+ AND THERAPEUTIC PEPTIDES DELIVERED VIA IONTOPHORESIS FOR ENHANCED AND PROLONGED REGENERATIVE EFFECTS ANDREWS NICHOLAS JEROME (US) 2025-11-27 — — US disclosed
US-20250281531-A1 METHODS AND COMPOSITIONS FOR DETOXIFICATION OF CHRONIC EXPOSURE TO TOXINS MDLifespan Enterprises, LLC 2025-09-11 — — US disclosed
US-20250034545-A1 MODIFICATIONS OF PEPTIDE COMPOSITIONS TO INCREASE STABILITY AND DELIVERY EFFICIENCY KAI PHARMACEUTICALS, INC. 2025-01-30 — — US disclosed
CN-111352826-B Automatic interface test case generation method and tool 上海云扩信息科技有限公司 2024-05-03 — — CN disclosed
US-20220282239-A1 MODIFICATIONS OF PEPTIDE COMPOSITIONS TO INCREASE STABILITY AND DELIVERY EFFICIENCY KAI PHARMACEUTICALS, INC. 2022-09-08 — — US disclosed
Send feedback