SCHEMBL27150870

SCHEMBL27150870

C[N+](C)(C)C[C@H](O)CC(=O)NCCCC[C@H](N)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ OTC P00480 1/20 0.48
▸ NOD1 Q9Y239 2/20 0.41
▸ GSR P00390 1/20 0.41
▸ SLC22A16 Q86VW1 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ DPP7 Q9UHL4 1/20 0.39
▸ ARG2 P78540 4/20 0.38
▸ ARG1 P05089 3/20 0.38
▸ NOS2 P35228 3/20 0.38
▸ NOS3 P29474 2/20 0.38
▸ NOS1 P29475 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ GNAI3 P08754 1/20 0.38
▸ GNAO1 P09471 1/20 0.38
▸ GNAI1 P63096 1/20 0.38

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
SCHEMBL25408052 1.00 OTC (0.48) OTCNOD1GSRSLC22A16MAPT
SCHEMBL25408044 1.00 OTC (0.48) OTCNOD1GSRSLC22A16MAPT
SCHEMBL29128940 0.82 OTC (0.53) OTCNOD1GSRDPP7ARG2
SCHEMBL31207026 0.82 OTC (0.53) OTCNOD1GSRDPP7ARG2
SCHEMBL25408373 0.82 OTC (0.53) OTCNOD1GSRDPP7ARG2
SCHEMBL25408376 0.82 OTC (0.53) OTCNOD1GSRDPP7ARG2
SCHEMBL18350239 0.81 OTC (0.58) OTCNOD1GSRDPP7ARG2
SCHEMBL4550454 0.80 OTC (0.54) OTCNOD1GSRDPP7ARG2
SCHEMBL30411132 0.80 OTC (0.54) OTCNOD1GSRDPP7ARG2
L-Citrulline SCHEMBL25363292 0.80 SLC22A16 (0.53) OTCGSRSLC22A16MAPTNOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066131-A1 CONJUGATED HEPCIDIN MIMETICS PROTAGONIST THERAPEUTICS, INC. (US) 2024-02-29 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240066131-A1 CONJUGATED HEPCIDIN MIMETICS HAMP, VIP, HDGF OTC 2771/4885NOD1 1407/4885GSR 2345/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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