SCHEMBL18016507

SCHEMBL18016507

C=C1NC(=O)C(C)=CN1[C@@H]1O[C@H](CO)C(N)[C@@H]1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 2/20 0.36
▸ LMNA P02545 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MTOR P42345 2/20 0.34
▸ GMNN O75496 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ DNMT1 P26358 1/20 0.34
▸ THPO P40225 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ HBB P68871 1/20 0.34
▸ PMP22 Q01453 1/20 0.34
▸ CDA P32320 4/20 0.33
▸ SLC28A1 O00337 1/20 0.33
▸ SLC28A2 O43868 1/20 0.33
▸ SLC29A1 Q99808 1/20 0.33
▸ SLC28A3 Q9HAS3 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 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
SCHEMBL25458682 0.89 CDA (0.42) LMNAALDH1A1MTORGMNNTP53
SCHEMBL18016515 0.87 ADORA3 (0.37) ADORA3LMNAALDH1A1MTORGMNN
SCHEMBL18016510 0.83 CHEK1 (0.34) LMNAALDH1A1MTORGMNNTP53
SCHEMBL20750703 0.81 DYRK1A (0.36) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL12718545 0.78 TK2 (0.35) LMNAALDH1A1MTORGMNNTP53
SCHEMBL17463479 0.76 P2RY2 (0.36) —
SCHEMBL15249018 0.76 P2RY2 (0.36) —
SCHEMBL14945957 0.76 P2RY2 (0.36) —
SCHEMBL14928661 0.76 P2RY2 (0.36) —
SCHEMBL18118099 0.76 P2RY2 (0.36) —

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-20160237108-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF ARES CAPITAL CORPORATION, AS AGENT 2016-08-18 — — 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-20160237108-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF NSUN3, POLRMT, TRDMT1 ADORA3 1639/4885LMNA 1343/4885ALDH1A1 3790/4885

“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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