SCHEMBL8235193

SCHEMBL8235193

C1CCC2NCCNC3CCCCC3NCCNCCNC2C1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
CXCR4 P61073 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.38
MAPT P10636 1/20 0.38
PDE4A P27815 1/20 0.38
KDR P35968 1/20 0.38
ALDH1A1 P00352 2/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 1/20 0.32
EPAS1 Q99814 1/20 0.30
EPHX1 P07099 1/20 0.30

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
SCHEMBL8422596 1.00 L3MBTL1 (0.40) L3MBTL1CXCR4SMN1; SMN2HIF1AMAPT
SCHEMBL8237916 1.00 L3MBTL1 (0.40) L3MBTL1CXCR4SMN1; SMN2HIF1AMAPT
SCHEMBL6156333 1.00 L3MBTL1 (0.40) L3MBTL1CXCR4SMN1; SMN2HIF1AMAPT
SCHEMBL13104857 1.00 L3MBTL1 (0.40) L3MBTL1CXCR4SMN1; SMN2HIF1AMAPT
SCHEMBL8237919 1.00 L3MBTL1 (0.40) L3MBTL1CXCR4SMN1; SMN2HIF1AMAPT
SCHEMBL8235477 0.97 L3MBTL1 (0.39) L3MBTL1CXCR4SMN1; SMN2HIF1AMAPT
Bromide SCHEMBL3966706 0.97 L3MBTL1 (0.39) L3MBTL1CXCR4SMN1; SMN2HIF1AMAPT
SCHEMBL214038 0.90 L3MBTL1 (0.46) L3MBTL1ALDH1A1PKMMAPK1EPAS1
SCHEMBL939664 0.90 L3MBTL1 (0.46) L3MBTL1ALDH1A1PKMMAPK1EPAS1
SCHEMBL22389997 0.90 L3MBTL1 (0.46) L3MBTL1ALDH1A1PKMMAPK1EPAS1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090131377-A1 Combinations of Superoxide Dismutase Mimetics and Nonsteroidal Analgesic/Anti-Inflammatory Drugs METAPHORE PHARMACEUTICALS, INC. (US) 2009-05-21 US disclosed
US-7445641-B1 Biomaterials modified with superoxide dismutase mimics PHARMACIA CORPORATION (US) 2008-11-04 US disclosed
WO-2006083508-A2 COMBINATIONS OF SUPEROXIDE DISMUTASE MIMETICS AND NONSTEROIDAL ANALGESIC/ANTI-INFLAMMATORY DRUGS METAPHORE PHARMACEUTICALS INC. (US) 2006-08-10 WO disclosed
US-20050171198-A1 SODm therapy for treatment, prevention, inhibition and reversal of inflammatory disease METAPHORE PHARMACEUTICALS, INC. 2005-08-04 US disclosed
US-20050171198-A1 SODm therapy for treatment, prevention, inhibition and reversal of inflammatory disease METAPHORE PHARMACEUTICALS, INC. 2005-08-04 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 (2 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-20050171198-A1 SODm therapy for treatment, prevention, inhibition and reversal of inflammatory disease SOD1, MPO, SOD3 L3MBTL1 3171/4885CXCR4 1255/4885SMN1; SMN2 320/4885
US-20090131377-A1 Combinations of Superoxide Dismutase Mimetics and Nonsteroidal Analgesic/Anti-Inflammatory Drugs SOD1, SOD3, CAT L3MBTL1 2538/4885CXCR4 3758/4885SMN1; SMN2 328/4885

“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.