SCHEMBL6517306

SCHEMBL6517306

NCCCCCCCCCC(N)(N)N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.53
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA3 P07451 2/20 0.53
CA4 P22748 2/20 0.53
CA6 P23280 2/20 0.53
CA5A P35218 2/20 0.53
CA7 P43166 2/20 0.53
CA9 Q16790 2/20 0.53
CA14 Q9ULX7 2/20 0.53
CA5B Q9Y2D0 2/20 0.53
TSHR P16473 2/20 0.53
LMNA P02545 1/20 0.53
BLM P54132 1/20 0.53
NFKB1 P19838 1/20 0.47
FDPS P14324 2/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL1195699 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL121803 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL29080417 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL10437125 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL4157260 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL28473192 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
Hydrochloric Acid SCHEMBL11124074 0.97 DNM1 (0.50) DNM1CA12CA1CA2CA3
SCHEMBL1275650 0.97
Boric Acid SCHEMBL8961512 0.89 DNM1 (0.42) DNM1CA12CA1CA2CA3
Putrescine SCHEMBL8585748 0.87 DNM1 (0.65) DNM1CA12CA1CA2CA3

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-20050249663-A1 Coadministration of transport protein with conjugated cobalamin to deliver agents MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2005-11-10 US disclosed
US-5948878-A Cationic polymers for nucleic acid transfection and bioactive agent delivery AVANTI POLAR LIPIDS, INC 1999-09-07 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-20050249663-A1 Coadministration of transport protein with conjugated cobalamin to deliver agents SLC19A1, SLC19A2, SLC46A1 DNM1 4046/4885CA12 2903/4885CA1 4531/4885

“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.