SCHEMBL2233415

SCHEMBL2233415

CCOCCN(CCP(=O)(OCC)OCC)CCP(=O)(OCC)OCC

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.45
TSHR P16473 2/20 0.41
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 2/20 0.33
TP53 P04637 1/20 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
SCHEMBL2236162 0.89 PPARD (0.42) PPARDTSHRMEN1GAACYP2C9
SCHEMBL2234140 0.89 PPARD (0.42) PPARDTSHRMEN1GAACYP2C9
SCHEMBL2234247 0.86 PPARD (0.47) PPARDTSHRMEN1GAACYP2C9
SCHEMBL2235786 0.85
SCHEMBL14782075 0.82 MEN1 (0.50) PPARDTSHRMEN1GAACYP2C9
SCHEMBL2234204 0.80 PPARD (0.41) PPARDTSHRMEN1GAACYP2C9
SCHEMBL19316395 0.79 PPARD (0.52) PPARDTSHRTDP1TP53
SCHEMBL9003229 0.79 PPARD (0.52) PPARDTSHRMEN1GAACYP2C9
SCHEMBL2235703 0.79 PPARD (0.44) PPARDTSHRMEN1GAACYP2C9
SCHEMBL4164665 0.79 PPARD (0.56) PPARDTSHRMEN1GAACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8182789-B2 Intermediate compound of technetium nitride complex for radiodiagnostic imaging NIHON MEDI-PHYSICS CO., LTD. (JP) 2012-05-22 US disclosed
US-8182789-B2 Intermediate compound of technetium nitride complex for radiodiagnostic imaging NIHON MEDI-PHYSICS CO., LTD. (JP) 2012-05-22 US disclosed
EP-1973923-B1 INTERMEDIATE COMPOUND OF TECHNETIUM NITRIDE COMPLEX FOR RADIODIAGNOSTIC IMAGING NIHON MEDIPHYSICS CO LTD (JP) 2011-08-17 EP disclosed
US-20100160615-A1 INTERMEDIATE COMPOUND OF TECHNETIUM NITRIDE COMPLEX FOR RADIODIAGNOSTIC IMAGING NIHON MED-PHYSICS CO., LTD. (JP) 2010-06-24 US disclosed
US-20100160615-A1 INTERMEDIATE COMPOUND OF TECHNETIUM NITRIDE COMPLEX FOR RADIODIAGNOSTIC IMAGING NIHON MED-PHYSICS CO., LTD. (JP) 2010-06-24 US disclosed
EP-1973923-A1 INTERMEDIATE COMPOUND OF TECHNETIUM NITRIDE COMPLEX FOR RADIODIAGNOSTIC IMAGING NIHON MEDI-PHYSICS CO., LTD. (JP) 2008-10-01 EP disclosed
US-20080124273-A1 Novel cationic metal complex radiopharmaceuticals PURDUE RESEARCH FOUNDATION 2008-05-29 US disclosed
WO-2007083395-A1 INTERMEDIATE COMPOUND OF TECHNETIUM NITRIDE COMPLEX FOR RADIODIAGNOSTIC IMAGING NIHON MEDI-PHYSICS CO., LTD. (JP) 2007-07-26 WO disclosed
WO-2006080993-A1 NOVEL CATIONIC METAL COMPLEX RADIOPHARMACEUTICALS PURDUE RESEARCH FOUNDATION (US) 2006-08-03 WO 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-20080124273-A1 Novel cationic metal complex radiopharmaceuticals SLC39A14, CLTC, TMEM165 PPARD 1067/4885TSHR 100/4885MEN1 56/4885
US-20100160615-A1 INTERMEDIATE COMPOUND OF TECHNETIUM NITRIDE COMPLEX FOR RADIODIAGNOSTIC IMAGING MEN1, NCDN, C1R PPARD 2640/4885TSHR 33/4885MEN1 1/4885

“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.