SCHEMBL26606126

SCHEMBL26606126

C=C(c1ccccc1)N1CCC(C(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.39
▸ OPRL1 P41146 1/20 0.37
▸ NPY2R P49146 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ EPHX1 P07099 1/20 0.36
▸ L3MBTL3 Q96JM7 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ XBP1 P17861 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL2603247 0.80 ACHE (0.68) ACHEALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL18133468 0.76 HRH3 (0.49) ALDH1A1KCNH2HRH3
SCHEMBL25945885 0.74 ACHE (0.59) ACHEALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL12261876 0.74 ACHE (0.59) ACHEALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL20233114 0.74 ACHE (0.59) ACHEALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL21431341 0.74 RIPK1 (0.34) —
SCHEMBL1934947 0.74 HPGD (0.55) ALDH1A1MEN1KMT2ANPC1
SCHEMBL24722046 0.73 L3MBTL3 (0.67) L3MBTL1L3MBTL3
SCHEMBL21508038 0.73 POLB (0.50) ALDH1A1KMT2AL3MBTL1NPC1MAPT
SCHEMBL3731573 0.72 HPGD (0.59) ALDH1A1MEN1KMT2A

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-11795159-B2 Compounds for the treatment of SARS PURDUE RESEARCH FOUNDATION (US) 2023-10-24 — — 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-11795159-B2 Compounds for the treatment of SARS ACE2, ACE, SARS1 ACHE 286/4885ALDH1A1 3093/4885NPSR1 854/4885

“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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