SCHEMBL8851169

SCHEMBL8851169

CNCCN(C)C1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRMT3 O60678 1/20 0.39
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
PRMT1 Q99873 1/20 0.39
PRMT8 Q9NR22 1/20 0.39
NOS3 P29474 2/20 0.34
NOS1 P29475 2/20 0.34
NOS2 P35228 2/20 0.34
GNAI3 P08754 2/20 0.31
GNAO1 P09471 2/20 0.31
GNAI1 P63096 2/20 0.31

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
SCHEMBL8852113 0.89 NOS3 (0.33) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL12478430 0.85
SCHEMBL12478238 0.83 PRMT1 (0.46) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL8334637 0.81 PRMT1 (0.44) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL8852165 0.81 GNAI3 (0.34) NOS3NOS1NOS2GNAI3GNAO1
Hydrochloric Acid SCHEMBL5572628 0.81 NOS3 (0.38) NOS3NOS1NOS2GNAI3GNAO1
SCHEMBL8851141 0.79 SLC6A2 (0.33) NOS3NOS1NOS2
SCHEMBL2002550 0.79 PRMT1 (0.42) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL13744550 0.78 CARM1 (0.41) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL8851762 0.77 SLC6A2 (0.40) PRMT3CARM1PRMT6PRMT1PRMT8

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-20230218597-A1 SUBSTITUTED PYRIDINES AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-07-13 US disclosed
US-5618814-A Trisubstituted pyrimido [5,4-d] pyrimidines for modulating multi-drug resistance and pharmaceutical compositions containing these compounds DR. KARL THOMAE GMBH (DE) 1997-04-08 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-20230218597-A1 SUBSTITUTED PYRIDINES AND METHODS OF USE ALK, ACVR1, ACVR2A PRMT3 1786/4885CARM1 2716/4885PRMT6 1221/4885

“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.