SCHEMBL18607192

SCHEMBL18607192

CC(=O)OC1C(COCc2ccccc2)OC(C)C(N)C1OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.46
▸ TSHR P16473 1/20 0.45
▸ TACR2 P21452 3/20 0.44
▸ GJB2 P29033 2/20 0.44
▸ SELP P16109 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ PTPN1 P18031 5/20 0.42
▸ CDC25B P30305 3/20 0.42
▸ PTPN2 P17706 1/20 0.41
▸ PTPN11 Q06124 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SSTR1 P30872 1/20 0.41
▸ SSTR2 P30874 1/20 0.41
▸ SSTR4 P31391 1/20 0.41
▸ SSTR3 P32745 1/20 0.41
▸ SSTR5 P35346 1/20 0.41
▸ CYP2D6 P10635 1/20 0.40

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
SCHEMBL24378581 0.88 GJB2 (0.50) NT5ETACR2GJB2PTPN1CDC25B
SCHEMBL20306742 0.87 NT5E (0.51) NT5ETSHRTACR2PTPN1CDC25B
SCHEMBL14218242 0.86 NT5E (0.48) NT5ETSHRTACR2GJB2LMNA
SCHEMBL12532834 0.86 NT5E (0.48) NT5ETSHRTACR2GJB2LMNA
SCHEMBL20229514 0.86 TSHR (0.53) NT5ETSHRTACR2SELPLMNA
SCHEMBL18392677 0.85 TSHR (0.47) NT5ETSHRTACR2LMNAKMT2A
SCHEMBL19184870 0.84 NT5E (0.51) NT5ETACR2GJB2SELPLMNA
SCHEMBL22677739 0.83 TACR2 (0.46) NT5ETSHRTACR2GJB2SELP
SCHEMBL8992030 0.83 NT5E (0.59) NT5ETSHRLMNAPTPN1CDC25B
SCHEMBL22073055 0.83 TSHR (0.50) NT5ETSHRTACR2LMNAPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3110825-B1 NOVEL SYNTHETIC OLIGOMERS OF NEISSERIA MENINGITIS SEROGROUP X AND PROCESS OF PREPARING THEM MSD WELLCOME TRUST HILLEMAN LABORATORIES PVT LTD (IN) 2020-12-09 — — EP disclosed
US-10183962-B2 Synthetic oligomers of Neisseria meningitis serogroup X and process of preparing them MSD WELLCOME TRUST HILLEMAN LABORATORIES PVT. LTD. (IN) 2019-01-22 — — US disclosed
US-20170066794-A1 NOVEL SYNTHETIC OLIGOMERS OF NEISSERIA MENINGITIS SEROGROUP X AND PROCESS OF PREPARING THEM MSD WELLCOME TRUST HILLEMAN LABORATORIES PVT. LTD. (IN) 2017-03-09 — — 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 (2 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-20170066794-A1 NOVEL SYNTHETIC OLIGOMERS OF NEISSERIA MENINGITIS SEROGROUP X AND PROCESS OF PREPARING THEM MLEC, MEN1, MAN2B2 NT5E 1458/4885TSHR 4302/4885TACR2 3521/4885
US-10183962-B2 Synthetic oligomers of Neisseria meningitis serogroup X and process of preparing them MLEC, MEN1, MAN2B2 NT5E 1421/4885TSHR 4300/4885TACR2 3408/4885

“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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