SCHEMBL1704787

SCHEMBL1704787

CCCCCCCCCc1ccc(N)c(CCCCCCCCC)c1CCCCCCCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.47
CYP3A4 P08684 3/20 0.44
TP53 P04637 2/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
ALOX5 P09917 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
LIPG Q9Y5X9 1/20 0.42
SKP2 Q13309 1/20 0.42
HTR2A P28223 1/20 0.41
TLR8 Q9NR97 6/20 0.39
SRC P12931 1/20 0.38
ESR1 P03372 2/20 0.37
ADRA2A P08913 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
TACR2 P21452 2/20 0.37

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
SCHEMBL1187291 1.00 TYR (0.47) TYRCYP3A4TP53MAPTMEN1
SCHEMBL5424900 1.00 TYR (0.47) TYRCYP3A4TP53MAPTMEN1
SCHEMBL2400771 1.00 TYR (0.47) TYRCYP3A4TP53MAPTMEN1
SCHEMBL1705721 1.00 TYR (0.47) TYRCYP3A4TP53MAPTMEN1
SCHEMBL2403029 1.00 TYR (0.47) TYRCYP3A4TP53MAPTMEN1
Hydrochloric Acid SCHEMBL5086818 0.98 TYR (0.46) TYRCYP3A4TP53MAPTMEN1
Iodide SCHEMBL5088359 0.98 TYR (0.46) TYRCYP3A4TP53MAPTMEN1
Bromide SCHEMBL5087274 0.98 TYR (0.46) TYRCYP3A4TP53MAPTMEN1
SCHEMBL29193291 0.98 TYR (0.46) TYRCYP3A4TP53MAPTMEN1
SCHEMBL2400391 0.98 TYR (0.44) TYRCYP3A4TP53MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2039698-B1 PHOSPHORUS MOLYBDENUM COMPOUND AND METHOD FOR PRODUCING THE SAME ADEKA CORP (JP) 2013-04-17 EP disclosed
EP-2078725-B1 PHOSPHORUS-MOLYBDENUM COMPOUND, METHOD FOR PRODUCING THE SAME, LUBRICANT ADDITIVE CONTAINING THE COMPOUND, AND LUBRICANT COMPOSITION ADEKA CORP (JP) 2012-04-18 EP disclosed
US-8071801-B2 Phosphorus molybdenum compound and method for producing same ADEKA CORPORATION (JP) 2011-12-06 US disclosed
US-8012916-B2 Phosphorus-molybdenum compound, method for producing same and lubricant additive and lubricant composition containing the compound ADEKA CORPORATION (JP) 2011-09-06 US disclosed
US-20090270289-A1 Phosphorus-molybdenum compound, method for producing same and lubricant additive and lubricant composition containing the compound ADEKA CORPORATION (JP) 2009-10-29 US disclosed
US-20090192062-A1 Phosphorus molybdenum compound and method for producing same ADEKA CORPORATION (JP) 2009-07-30 US disclosed
EP-2078725-A1 PHOSPHORUS-MOLYBDENUM COMPOUND, METHOD FOR PRODUCING THE SAME, LUBRICANT ADDITIVE CONTAINING THE COMPOUND, AND LUBRICANT COMPOSITION Adeka Corporation (JP) 2009-07-15 EP disclosed
EP-2039698-A1 PHOSPHORUS MOLYBDENUM COMPOUND AND METHOD FOR PRODUCING THE SAME Adeka Corporation (JP) 2009-03-25 EP disclosed
US-20070155636-A1 Lubricating oil additive and lubricating oil composition containing the same ADEKA CORPORATION (JP) 2007-07-05 US disclosed
EP-1717298-A1 LUBRICATING OIL ADDITIVE AND LUBRICATING OIL COMPOSITION CONTAINING SAME Adeka Corporation (JP) 2006-11-02 EP 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-20090270289-A1 Phosphorus-molybdenum compound, method for producing same and lubricant additive and lubricant composition containing the compound JAK1, PRDX1, PRDX4 TYR 805/4885CYP3A4 2524/4885TP53 2621/4885
US-20090192062-A1 Phosphorus molybdenum compound and method for producing same PHPT1, PHOSPHO1, MPHOSPH6 TYR 940/4885CYP3A4 2569/4885TP53 3811/4885

“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.