SCHEMBL24047168

SCHEMBL24047168

CC(C)Sc1ccc(CN2CCOCC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 6/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ NOS3 P29474 1/20 0.49
▸ NOS1 P29475 1/20 0.49
▸ NOS2 P35228 1/20 0.49
▸ MAPT P10636 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ KCNJ1 P48048 1/20 0.48
▸ HIF1A Q16665 2/20 0.44
▸ EPAS1 Q99814 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ HPGD P15428 1/20 0.44

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
SCHEMBL24047165 0.85 HRH3 (0.59) HRH3SMN1; SMN2ALDH1A1
SCHEMBL24047167 0.83 HRH3 (0.62) HRH3SMN1; SMN2ALDH1A1
SCHEMBL21884103 0.81 HRH3 (0.65) HRH3SMN1; SMN2NOS3NOS1NOS2
SCHEMBL24047673 0.81 SIGMAR1 (0.54) HRH3
SCHEMBL15467001 0.80 HRH3 (0.87) HRH3SMN1; SMN2NOS3NOS1NOS2
SCHEMBL10159880 0.78 HRH3 (0.65) HRH3SMN1; SMN2NOS3NOS1NOS2
SCHEMBL4547887 0.78 HRH3 (0.65) HRH3SMN1; SMN2NOS3NOS1NOS2
SCHEMBL19441606 0.77 HRH3 (0.62) HRH3SMN1; SMN2NOS3NOS1NOS2
SCHEMBL19441582 0.77 HRH3 (0.62) HRH3SMN1; SMN2NOS3NOS1NOS2
SCHEMBL11864 0.75 HRH3 (0.71) HRH3SMN1; SMN2NOS3NOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203081-A1 LINCOSAMIDE ANTIBIOTICS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-06-29 — — US disclosed
WO-2021236911-A1 LINCOSAMIDE ANTIBIOTICS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-11-25 — — WO 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-20230203081-A1 LINCOSAMIDE ANTIBIOTICS AND USES THEREOF NPEPPS, TLR7, ASNS HRH3 3843/4885SMN1; SMN2 2150/4885NOS3 1876/4885

“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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