SCHEMBL3583747

SCHEMBL3583747

C[CH]C1CCC(N2CCN(C)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.33
PIM1 P11309 1/20 0.33
L3MBTL3 Q96JM7 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 2/20 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
SCHEMBL81624 0.83 L3MBTL1 (0.39) HRH3PIM1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL21527124 0.81 HRH3 (0.32) HRH3PIM1L3MBTL3L3MBTL1
SCHEMBL16924619 0.81 L3MBTL3 (0.35) HRH3PIM1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL22519024 0.79 L3MBTL1 (0.41) HRH3PIM1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL15217801 0.77 L3MBTL1 (0.36) HRH3PIM1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL18563138 0.77 KDM4E (0.38) HRH3PIM1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL3580649 0.76 KDM4E (0.33) ALDH1A1
SCHEMBL3590285 0.76 KDM4E (0.33) ALDH1A1
SCHEMBL3436969 0.76 L3MBTL1 (0.46) HRH3PIM1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL3376050 0.76

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-20100029636-A1 Lck inhibitors NOVARTIS AG (CH) 2010-02-04 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-20100029636-A1 Lck inhibitors LCK, ZAP70, FYN HRH3 3567/4885PIM1 125/4885L3MBTL3 2360/4885

“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.