SCHEMBL4615149

SCHEMBL4615149

Cc1c(C(=O)O)n(C)c2ccc(C(F)(F)F)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.47
KIF11 P52732 1/20 0.44
DHODH Q02127 1/20 0.41
KDM4E B2RXH2 5/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 3/20 0.41
PGR P06401 1/20 0.40
NR1H3 Q13133 1/20 0.40
PTGER4 P35408 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 2/20 0.40
HSD17B10 Q99714 2/20 0.40
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
TEAD1 P28347 1/20 0.39
TEAD4 Q15561 1/20 0.39
TEAD2 Q15562 1/20 0.39

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
Guanidine SCHEMBL8690725 0.92 SRC (0.42) SRCKIF11DHODHKDM4EMEN1
SCHEMBL4616695 0.82 ALOX5 (0.50) SRCKDM4EKMT2AHPGDALDH1A1
SCHEMBL4616719 0.80 KDM4E (0.50) SRCKDM4EMEN1KMT2AHPGD
SCHEMBL16729412 0.78 KIF11 (0.51) SRCKIF11KDM4EMEN1KMT2A
SCHEMBL4614815 0.77 MCL1 (0.45) KDM4EKMT2AL3MBTL1MAPTTSHR
SCHEMBL22031980 0.77 PGR (0.49) SRCKIF11MEN1KMT2APGR
SCHEMBL18422708 0.77 PPARG (0.49) SRCDHODHHPGDPTGDR2ALDH1A1
SCHEMBL24483423 0.76 PTGER4 (0.59) SRCKIF11DHODHMEN1KMT2A
SCHEMBL13383054 0.75 KIF11 (0.65) SRCKIF11KDM4EMEN1KMT2A
SCHEMBL9956776 0.75 KDM4E (0.52) KDM4EMEN1KMT2AHPGDL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1697304-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2008-02-20 EP disclosed
EP-1697304-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2008-02-20 EP disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 US disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 US disclosed
EP-1697304-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2006-09-06 EP disclosed
WO-2005054176-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-06-16 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 (1 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-20070082907-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD SRC 2893/4885KIF11 2068/4885DHODH 2283/4885

“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.