SCHEMBL23346524

SCHEMBL23346524

CCCC(C)C(=O)NC[C@@H]1C[C@H](CNC)CN1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HPGD P15428 1/20 0.33
▸ GPR88 Q9GZN0 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL23346565 0.84 MTNR1A (0.32) —
SCHEMBL23346522 0.78 FUCA1 (0.41) —
SCHEMBL20685675 0.71 MTNR1A (0.32) —
SCHEMBL20685659 0.71 MTNR1A (0.32) —
SCHEMBL23165447 0.71 MTNR1A (0.32) —
SCHEMBL23165445 0.71 MTNR1A (0.32) —
SCHEMBL23346523 0.71 GLB1 (0.36) —
SCHEMBL20685676 0.70 MTNR1A (0.30) —
SCHEMBL23346582 0.69 — —
SCHEMBL23346519 0.69 MTNR1A (0.32) —

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-20210137881-A1 BACTERIAL EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERISTY OF NEW JERSEY (US) 2021-05-13 — — 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-20210137881-A1 BACTERIAL EFFLUX PUMP INHIBITORS ABCB11, ABCB1, SLC47A1 LMNA 3655/4885MAPT 4395/4885MAPK1 1771/4885

“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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