SCHEMBL17471822

SCHEMBL17471822

CN(C)CCCNC(=O)N1CCC(C(C)(C)C)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ HTT P42858 2/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.40
▸ P2RX4 Q99571 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ DNM1 Q05193 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ NAMPT P43490 1/20 0.37
▸ TPSAB1 Q15661 1/20 0.36
▸ TPSD1 Q9BZJ3 1/20 0.36
▸ TPSG1 Q9NRR2 1/20 0.36
▸ KMT2A Q03164 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
SCHEMBL17471132 0.84 NAMPT (0.43) LMNAHTTCYP2D6KCNH2HRH3
SCHEMBL18557408 0.83 ALDH1A1 (0.46) LMNAHTTP2RX4TDP1DNM1
SCHEMBL17471820 0.81 CYP2C19 (0.50) LMNAHTTCYP2D6KCNH2HRH3
SCHEMBL13225898 0.78 KMT2A (0.62) LMNAHTTCYP2D6KCNH2HRH3
SCHEMBL17471147 0.77 LMNA (0.52) LMNAHTTCYP2D6ALDH1A1
SCHEMBL19698170 0.76 TPSAB1 (0.37) LMNAHTTCYP2D6KCNH2HRH3
SCHEMBL17471129 0.75 HDAC2 (0.42) HTTCYP2D6KCNH2HRH3EPHX2
SCHEMBL17471127 0.75 TPSAB1 (0.45) CYP2D6KCNH2HRH3NAMPTTPSAB1
SCHEMBL19698171 0.75 DRD2 (0.39) LMNAHTTALDH1A1NAMPTTPSAB1
SCHEMBL19698161 0.74 MGLL (0.41) LMNAHTTALDH1A1NAMPTTPSAB1

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-9580415-B2 Compounds PROXIMAGEN LIMITED (GB) 2017-02-28 — — US disclosed
US-20160024080-A1 NEW COMPOUNDS PROXIMAGEN, LLC 2016-01-28 — — 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-20160024080-A1 NEW COMPOUNDS QSOX1, MAOB, MAOA LMNA 1714/4885ALOX15 46/4885HTT 2102/4885

“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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