SCHEMBL23840694

SCHEMBL23840694

CC(C)(C)CCCn1ccccc1=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.50
▸ MITF O75030 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ TP53 P04637 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ PSMB1 P20618 2/20 0.41
▸ TSHR P16473 1/20 0.36
▸ DRD2 P14416 1/20 0.36
▸ PLD1 Q13393 1/20 0.35
▸ PSMB5 P28074 1/20 0.34

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
SCHEMBL15348176 0.95 NPC1 (0.49) NPC1MITFLMNATP53RAB9A
SCHEMBL11613552 0.89 NPC1 (0.53) NPC1MITFLMNATP53RAB9A
SCHEMBL9394796 0.82 L3MBTL1 (0.51) NPC1MITFLMNATP53RAB9A
SCHEMBL9752675 0.82 L3MBTL1 (0.51) NPC1MITFLMNATP53RAB9A
SCHEMBL9752571 0.81 L3MBTL1 (0.50) NPC1MITFLMNATP53RAB9A
SCHEMBL9752728 0.81 L3MBTL1 (0.50) NPC1MITFLMNATP53RAB9A
SCHEMBL9752719 0.81 L3MBTL1 (0.50) NPC1MITFLMNATP53RAB9A
SCHEMBL6727933 0.79 L3MBTL1 (0.47) NPC1MITFLMNATP53RAB9A
SCHEMBL9752595 0.78 L3MBTL1 (0.55) NPC1MITFLMNATP53RAB9A
SCHEMBL2495415 0.78 TP53 (0.45) NPC1MITFLMNATP53RAB9A

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
US-11771677-B2 Immunomodulating urea azalides ZOETIS SERVICES LLC (US) 2023-10-03 — — US disclosed
US-11771677-B2 Immunomodulating urea azalides ZOETIS SERVICES LLC (US) 2023-10-03 — — US disclosed
US-20210290591-A1 IMMUNOMODULATING UREA AZALIDES ZOETIS SERVICES LLC 2021-09-23 — — 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-11771677-B2 Immunomodulating urea azalides ARG1, IL2, CD209 NPC1 3229/4885MITF 1386/4885LMNA 4881/4885
US-20210290591-A1 IMMUNOMODULATING UREA AZALIDES ARG1, IL2, CD209 NPC1 3229/4885MITF 1386/4885LMNA 4881/4885

“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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