SCHEMBL4089153

SCHEMBL4089153

O=C(O)c1cc(NCCc2ccc(OC(F)(F)F)cc2)ccc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.50
KDM4C Q9H3R0 1/20 0.50
STING1 Q86WV6 1/20 0.50
PTPRC P08575 1/20 0.48
PTPN2 P17706 1/20 0.48
PTPN1 P18031 1/20 0.48
PTPN6 P29350 1/20 0.48
PTPN9 P43378 1/20 0.48
DUSP3 P51452 1/20 0.48
PTPN11 Q06124 1/20 0.48
PTPN22 Q9Y2R2 1/20 0.48
SYK P43405 4/20 0.47
EPHX2 P34913 2/20 0.47
LTA4H P09960 1/20 0.47
NOX4 Q9NPH5 2/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
RGS12 O14924 1/20 0.45
EGFR P00533 1/20 0.45
LCK P06239 1/20 0.45

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
SCHEMBL609252 0.85 SYK (0.60) PPARAKDM4CSTING1SYKNOX4
SCHEMBL608498 0.84 KDM4C (0.53) PPARAKDM4CSTING1SYKNOX4
SCHEMBL4116154 0.82 KDM4C (0.52) PPARAKDM4CSTING1SYKNOX4
SCHEMBL608754 0.82 NOX4 (0.61) PPARAKDM4CSTING1PTPN1SYK
SCHEMBL610123 0.81 SYK (0.58) PPARAKDM4CSTING1SYKNOX4
SCHEMBL29388077 0.81 SYK (0.58) PPARAKDM4CSTING1SYKNOX4
SCHEMBL4095004 0.81 KDM4C (0.56) PPARAKDM4CSTING1SYKNOX4
Sulfuric Acid SCHEMBL1170031 0.80 PPARA (0.49) PPARAKDM4CSTING1SYKNOX4
SCHEMBL608886 0.79 KDM4C (0.50) PPARAKDM4CSTING1NOX4ALDH1A1
SCHEMBL4097800 0.77 PPARA (0.52) PPARAKDM4CSTING1PTPN1SYK

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-20090149542-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING NEURONAL DEATH OR NEUROLOGICAL DYSFUNCTION NEUROTECH PHARMACEUTICALS CO., LTD. (KR) 2009-06-11 US claimed
US-20070298129-A1 Compounds and compositions for treating neuronal death or neurological dysfunction NEUROTECH PHARMACEUTICALS CO., LTD. (KR) 2007-12-27 US claimed
US-20120301551-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING NEURONAL DEATH OR NEUROLOGICAL DYSFUNCTION NEUROTECH PHARMACEUTICALS CO., LTD. (KR) 2012-11-29 US disclosed
US-20090149542-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING NEURONAL DEATH OR NEUROLOGICAL DYSFUNCTION NEUROTECH PHARMACEUTICALS CO., LTD. (KR) 2009-06-11 US disclosed
US-20070298129-A1 Compounds and compositions for treating neuronal death or neurological dysfunction NEUROTECH PHARMACEUTICALS CO., LTD. (KR) 2007-12-27 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 (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-20090149542-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING NEURONAL DEATH OR NEUROLOGICAL DYSFUNCTION BCL2, BAX, SMN1; SMN2 PPARA 1265/4885KDM4C 3544/4885STING1 3945/4885
US-20120301551-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING NEURONAL DEATH OR NEUROLOGICAL DYSFUNCTION BCL2, BAX, SMN1; SMN2 PPARA 1265/4885KDM4C 3544/4885STING1 3945/4885
US-20070298129-A1 Compounds and compositions for treating neuronal death or neurological dysfunction BCL2, BAX, SMN1; SMN2 PPARA 1265/4885KDM4C 3544/4885STING1 3945/4885

“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.