SCHEMBL3589693

SCHEMBL3589693

[CH2]CC1CCC(N2CCN(C)CC2)C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.33
HRH3 Q9Y5N1 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ACHE P22303 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
SCHEMBL3594708 0.89 KDM4E (0.33) NCF1KDM4ETDP1
SCHEMBL3587614 0.88 NCF1 (0.35) NCF1HRH3KDM4EACHE
SCHEMBL16675700 0.78 KDM1A (0.33) NCF1
SCHEMBL12027664 0.78 KDM1A (0.33) NCF1
SCHEMBL20322474 0.75 HRH3 (0.33) HRH3KDM4E
SCHEMBL22570156 0.74 MEN1 (0.45) NCF1HRH3KDM4EACHE
SCHEMBL7943522 0.74 MEN1 (0.45) NCF1HRH3KDM4EACHE
SCHEMBL22570309 0.74 MEN1 (0.45) NCF1HRH3KDM4EACHE
SCHEMBL81624 0.73 L3MBTL1 (0.39) NCF1HRH3KDM4ETDP1ACHE
SCHEMBL22179237 0.72 NCF1 (0.35) NCF1HRH3KDM4EACHE

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 NCF1 623/4885HRH3 3567/4885KDM4E 557/4885

“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.