SCHEMBL22844085

SCHEMBL22844085

NCCOCCOCC(=O)NCCOCCOCC(=O)NCCCC[C@H](N)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GSR P00390 1/20 0.45
▸ OTC P00480 1/20 0.45
▸ GLP1R P43220 8/20 0.44
▸ GNAI3 P08754 1/20 0.38
▸ GNAO1 P09471 1/20 0.38
▸ GNAI1 P63096 1/20 0.38
▸ CA2 P00918 1/20 0.37
▸ NOD1 Q9Y239 2/20 0.37
▸ DDAH1 O94760 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.36
▸ ARG1 P05089 1/20 0.36
▸ ARG2 P78540 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
SCHEMBL24838646 0.97 GSR (0.47) GSROTCGLP1RGNAI3GNAO1
SCHEMBL19135682 0.90 GLP1R (0.51) GSROTCGLP1RNOD1DDAH1
SCHEMBL24470266 0.88 GLP1R (0.48) OTCGLP1RNOD1DDAH1
SCHEMBL19801989 0.88 GLP1R (0.45) OTCGLP1RNOD1
SCHEMBL24788157 0.88 OTC (0.47) GSROTCGLP1RNOD1DDAH1
SCHEMBL24788148 0.88 GLP1R (0.50) OTCGLP1RGNAI3GNAO1GNAI1
SCHEMBL24788082 0.88 GLP1R (0.45) GSROTCGLP1RNOD1DDAH1
SCHEMBL19599417 0.88 GLP1R (0.42) GSROTCGLP1RNOD1
SCHEMBL19599351 0.88 GLP1R (0.42) GSROTCGLP1RNOD1
SCHEMBL19599416 0.88 GLP1R (0.42) GSROTCGLP1RNOD1

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-20200407409-A1 EGF(A) ANALOGUES WITH FATTY ACID SUBSTITUENTS CHEN JIANHE (CN) 2020-12-31 — — 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-20200407409-A1 EGF(A) ANALOGUES WITH FATTY ACID SUBSTITUENTS EGFR, LDLR, FFAR2 GSR 1765/4885OTC 4147/4885GLP1R 39/4885

“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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