SCHEMBL26554382

SCHEMBL26554382

CCCCCCCCCCc1cccc2nc(NCCNC(=O)OC(C)(C)C)oc12

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 17/20 0.48
MTNR1B P49286 17/20 0.48
BCHE P06276 1/20 0.45
ELANE P08246 2/20 0.43

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
SCHEMBL29437064 1.00 MTNR1A (0.48) MTNR1AMTNR1BBCHEELANE
SCHEMBL26554383 0.95 MTNR1A (0.50) MTNR1AMTNR1BELANE
SCHEMBL29437088 0.95 MTNR1A (0.50) MTNR1AMTNR1BELANE
SCHEMBL25402731 0.86 MTNR1A (0.53) MTNR1AMTNR1BELANE
SCHEMBL26554385 0.85 TSHR (0.42) BCHEELANE
SCHEMBL29437053 0.85 TSHR (0.42) BCHEELANE
SCHEMBL25400647 0.81 MTNR1A (0.55) MTNR1AMTNR1BELANE
SCHEMBL29437005 0.81 BCHE (0.51) BCHE
SCHEMBL26554316 0.81 BCHE (0.51) BCHE
SCHEMBL29437063 0.80 TSHR (0.43) ELANE

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-20230331683-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. 2023-10-19 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-20230331683-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY SPNS2, SPCS2, SMN1; SMN2 MTNR1A 847/4885MTNR1B 531/4885BCHE 1326/4885

“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.