SCHEMBL3209535

SCHEMBL3209535

CC1CCN(CCOc2cccc(N)c2)CC1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.62
HRH3 Q9Y5N1 11/20 0.61
LTA4H P09960 1/20 0.60
SIGMAR1 Q99720 1/20 0.57
LMNA P02545 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL3206091 0.84 KMT2A (0.68) KDM4EHRH3LTA4HLMNAMAPK1
SCHEMBL264157 0.84 LTA4H (0.81) KDM4ELTA4HLMNAMAPK1HTT
SCHEMBL3216190 0.82 LTA4H (0.79) KDM4EHRH3LTA4HLMNAMAPK1
SCHEMBL3209561 0.82 LTA4H (0.79) KDM4EHRH3LTA4HLMNAMAPK1
SCHEMBL3866360 0.82 SIGMAR1 (0.71) KDM4EHRH3LTA4HSIGMAR1KMT2A
SCHEMBL5388793 0.82 HRH3 (0.71) KDM4EHRH3LTA4HSIGMAR1LMNA
Hydrochloric Acid SCHEMBL3859180 0.81 SIGMAR1 (0.74) KDM4EHRH3LTA4HSIGMAR1KMT2A
SCHEMBL7397402 0.81 TMEM97 (0.76) LTA4HSIGMAR1MEN1KMT2A
SCHEMBL2561445 0.80 KDM4E (0.62) KDM4EHRH3SIGMAR1LMNAMAPK1
SCHEMBL14320388 0.80 LTA4H (0.63) KDM4EHRH3LTA4HLMNAMAPK1

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-20100048891-A1 METASUBSTITUTED THIAZOLIDINONES, THEIR MANUFACTURE AND USE AS A DRUG SCHULZE KLAUSE 2010-02-25 US disclosed
US-20100048891-A1 METASUBSTITUTED THIAZOLIDINONES, THEIR MANUFACTURE AND USE AS A DRUG SCHULZE KLAUSE 2010-02-25 US disclosed
US-20100048891-A1 METASUBSTITUTED THIAZOLIDINONES, THEIR MANUFACTURE AND USE AS A DRUG SCHULZE KLAUSE 2010-02-25 US disclosed
US-20070015759-A1 Metasubstituted thiazolidinones, their manufacture and use as a drug BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-18 US disclosed
US-20070015759-A1 Metasubstituted thiazolidinones, their manufacture and use as a drug BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-18 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 (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-20100048891-A1 METASUBSTITUTED THIAZOLIDINONES, THEIR MANUFACTURE AND USE AS A DRUG PLK2, PDXK, PLK4 KDM4E 3035/4885HRH3 4815/4885LTA4H 2174/4885
US-20070015759-A1 Metasubstituted thiazolidinones, their manufacture and use as a drug PLK4, PDXK, PLK2 KDM4E 2470/4885HRH3 4823/4885LTA4H 1982/4885

“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.