SCHEMBL20149804

SCHEMBL20149804

CC[C@H]1O[C@@H](n2cnc3c(NC(=O)c4ccccc4)ncnc32)[C@@H](O)[C@@H]1N=[N+]=[N-]

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 2/20 0.52
▸ ADORA3 P0DMS8 2/20 0.51
▸ BMPR1B O00238 1/20 0.51
▸ ADORA1 P30542 4/20 0.49
▸ ADORA2A P29274 1/20 0.49
▸ ADORA2B P29275 1/20 0.49
▸ P2RY2 P41231 1/20 0.49
▸ P2RY1 P47900 1/20 0.49
▸ P2RY6 Q15077 1/20 0.49
▸ DNPH1 O43598 1/20 0.49

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
SCHEMBL25496518 1.00 P2RY12 (0.52) P2RY12ADORA3BMPR1BADORA1ADORA2A
SCHEMBL20149803 0.93 ALDH1A1 (0.54) P2RY12ADORA3BMPR1BADORA1ADORA2A
SCHEMBL15953489 0.93 ADORA1 (0.56) P2RY12ADORA3ADORA1ADORA2AADORA2B
SCHEMBL25496497 0.93 ADORA1 (0.56) P2RY12ADORA3ADORA1ADORA2AADORA2B
SCHEMBL15953492 0.93 ADORA1 (0.56) P2RY12ADORA3ADORA1ADORA2AADORA2B
SCHEMBL20149805 0.91 PRMT6 (0.47) P2RY12ADORA3BMPR1BADORA1ADORA2A
SCHEMBL25496726 0.91 PRMT6 (0.47) P2RY12ADORA3BMPR1BADORA1ADORA2A
SCHEMBL16261025 0.90 PRMT6 (0.51) P2RY12ADORA3BMPR1BADORA1ADORA2A
SCHEMBL20149808 0.89 PRMT6 (0.47) P2RY12ADORA3BMPR1BADORA1ADORA2A
SCHEMBL14364928 0.88 PRMT6 (0.58) P2RY12BMPR1BP2RY2P2RY1P2RY6

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-20180135054-A1 MODIFIED OLIGONUCLEOTIDES AND METHODS OF USE ALIOS BIOPHARMA, INC. (US) 2018-05-17 — — 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-20180135054-A1 MODIFIED OLIGONUCLEOTIDES AND METHODS OF USE NSUN2, ADAR, POLM P2RY12 3905/4885ADORA3 985/4885BMPR1B 2485/4885

“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.

Send feedback