SCHEMBL5510087

SCHEMBL5510087

ClCc1ccc(OCc2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.61
KMT2A Q03164 3/20 0.60
MEN1 O00255 2/20 0.60
NPSR1 Q6W5P4 2/20 0.56
LMNA P02545 1/20 0.56
S1PR1 P21453 1/20 0.55
LTK P29376 1/20 0.55
TAOK1 Q7L7X3 1/20 0.55
S1PR5 Q9H228 1/20 0.55
ALDH1A1 P00352 2/20 0.53
MAPT P10636 1/20 0.53
NCOA1 Q15788 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NCOA3 Q9Y6Q9 1/20 0.53
UBE2N P61088 1/20 0.52
IDO1 P14902 2/20 0.51
PTPN1 P18031 3/20 0.50
NR4A1 P22736 1/20 0.50
NR4A3 Q92570 1/20 0.50
INPPL1 O15357 1/20 0.47

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
SCHEMBL11705511 0.87 NR4A2 (0.58) NR4A2KMT2AMEN1NPSR1LMNA
SCHEMBL5512464 0.87 MAOB (0.52) NR4A2KMT2AMEN1NPSR1LMNA
SCHEMBL13181260 0.85 NR4A2 (0.60) NR4A2KMT2AMEN1NPSR1LMNA
SCHEMBL5514493 0.85 KMT2A (0.67) NR4A2KMT2AMEN1NPSR1LMNA
SCHEMBL11705156 0.83 NR4A2 (0.60) NR4A2KMT2AMEN1NPSR1LMNA
SCHEMBL966182 0.83 KMT2A (0.67) NR4A2KMT2AMEN1NPSR1LMNA
SCHEMBL6326819 0.81 NR4A2 (0.63) NR4A2KMT2AMEN1NPSR1LMNA
SCHEMBL11562469 0.81 NR4A2 (0.63) NR4A2KMT2AMEN1NPSR1LMNA
SCHEMBL13929701 0.81 NR4A2 (0.63) NR4A2KMT2AMEN1NPSR1LMNA
SCHEMBL27602683 0.79 MAOB (0.67) NR4A2KMT2AMEN1NPSR1LMNA

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
US-RE39916-E1 Compounds that modulate PPAR activity and methods for their preparation WARNER LAMBERT COMPANY (US) 2007-11-06 US disclosed
US-RE39916-E1 Compounds that modulate PPAR activity and methods for their preparation WARNER LAMBERT COMPANY (US) 2007-11-06 US disclosed
US-RE39916-E1 Compounds that modulate PPAR activity and methods for their preparation WARNER LAMBERT COMPANY (US) 2007-11-06 US disclosed
US-6964983-B2 Compounds that modulate PPAR activity and methods for their preparation WARNER-LAMBERT COMPANY, LLC (US) 2005-11-15 US disclosed
US-6939875-B2 Carbocyclic oxy sulfides such as [4-(Biphenyl-4-ylmethylsulfanyl)-5-methoxy-2-methyl-phenoxy]-acetic acid, used to control peroxisome proliferator activated receptors (PPAR), for prophylaxis of metabolic disorders WARNER-LAMBERT COMPANY (US) 2005-09-06 US disclosed
US-20050153996-A1 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION AUERBACH BRUCE J (US) 2005-07-14 US disclosed
US-20050113440-A1 Compounds that modulate PPAR activity and methods for their preparation AUERBACH BRUCE J (US) 2005-05-26 US disclosed
EP-1494989-A2 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION WARNER-LAMBERT COMPANY LLC (US) 2005-01-12 EP disclosed
US-20030225158-A1 Compounds that modulate PPAR activity and methods for their preparation WARNER-LAMBERT COMPANY 2003-12-04 US disclosed
WO-2003084916-A2 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION WARNER-LAMBERT COMPANY LLC (US) 2003-10-16 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 (3 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-20030225158-A1 Compounds that modulate PPAR activity and methods for their preparation GPR119, PPARA, PPARG NR4A2 651/4885KMT2A 2937/4885MEN1 3519/4885
US-20050113440-A1 Compounds that modulate PPAR activity and methods for their preparation GPR119, PPARA, PPARG NR4A2 651/4885KMT2A 2937/4885MEN1 3519/4885
US-20050153996-A1 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION GPR119, PPARA, PPARG NR4A2 651/4885KMT2A 2937/4885MEN1 3519/4885

“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.