SCHEMBL7092424

SCHEMBL7092424

N#CCCC(N)(CCC#N)CCCCCCCCCCCN

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOX P28300 1/20 0.40
LOXL3 P58215 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA3 P07451 2/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
CA5A P35218 2/20 0.35
CA7 P43166 2/20 0.35
CA9 Q16790 2/20 0.35
CA14 Q9ULX7 2/20 0.35
CA5B Q9Y2D0 2/20 0.35
DNM1 Q05193 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
BLM P54132 1/20 0.35
LCK P06239 1/20 0.33
FDPS P14324 1/20 0.32

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
SCHEMBL9184245 1.00 LOX (0.40) LOXLOXL3LOXL2CA12CA1
SCHEMBL25729480 0.96 LOX (0.37) LOXLOXL3LOXL2CA12CA1
SCHEMBL3674628 0.81 ALDH1A1 (0.44) LOXLOXL3LOXL2TSHR
SCHEMBL20425510 0.81 DNM1 (0.53) CA12CA1CA2CA3CA4
SCHEMBL817872 0.78 DNM1 (0.50) CA12CA1CA2CA3CA4
SCHEMBL28300322 0.78 DNM1 (0.50) CA12CA1CA2CA3CA4
SCHEMBL7093120 0.78 DNM1 (0.50) CA12CA1CA2CA3CA4
SCHEMBL817593 0.76 DNM1 (0.47) CA12CA1CA2CA3CA4
Bromide SCHEMBL5276683 0.76 NFKB1 (0.32) LOXLOXL3LOXL2CA12CA1
SCHEMBL2357721 0.75 NFKB1 (0.47) CA12CA1CA2CA3CA4

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-20030166601-A1 Novel colloid synthetic vectors for gene therapy WOODLE MARTIN C (US) 2003-09-04 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-20030166601-A1 Novel colloid synthetic vectors for gene therapy FUS, HNRNPUL2, HNRNPH1 LOX 3851/4885LOXL3 3270/4885LOXL2 3303/4885

“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.