SCHEMBL5865449

SCHEMBL5865449

CCCCCCc1cc([Si](C)(C)C)ccc1C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.38
PPARG P37231 2/20 0.38
HPSE Q9Y251 2/20 0.38
RXRA P19793 3/20 0.37
NR1H2 P55055 3/20 0.37
NR1H3 Q13133 1/20 0.37
FAAH O00519 1/20 0.37
TSHR P16473 3/20 0.36
KDM4E B2RXH2 1/20 0.35
NOD2 Q9HC29 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX5 P09917 1/20 0.35
MAPT P10636 1/20 0.35
TYR P14679 1/20 0.35
ALOX15 P16050 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL5865418 0.89 PPARA (0.36) PPARAPPARGHPSERXRANR1H2
SCHEMBL5865500 0.83 PPARA (0.51) PPARAPPARGRXRANR1H2NR1H3
SCHEMBL5865554 0.77 KDM4E (0.37) PPARAPPARGRXRANR1H2NR1H3
SCHEMBL5865070 0.75 PPARA (0.43) PPARAPPARGRXRANR1H2NR1H3
SCHEMBL4627318 0.75 PPARA (0.54) PPARAPPARGRXRANR1H2NR1H3
SCHEMBL27314741 0.74 ALOX5 (0.49) PPARAFAAHTSHRKDM4EMEN1
SCHEMBL4627209 0.74 THRA (0.39) PPARAPPARGRXRANR1H2NR1H3
SCHEMBL4627297 0.74 ALOX5 (0.36) PPARAPPARGRXRANR1H2NR1H3
SCHEMBL5865473 0.73 TSHR (0.36) HPSERXRANR1H2NR1H3TSHR
SCHEMBL29102441 0.73 PPARA (0.66) PPARAPPARGFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125999-B2 Process for producing organotitanium compound and process for addition reaction NISSAN CHEMICAL INDUSTIES, LTD. (JP) 2006-10-24 US disclosed
US-20040167344-A1 Process for producing organotitanium compound and process for addition reaction FUMIE SATO 2004-08-26 US disclosed
US-6743916-B2 REACTING AN ACETYLENE COMPOUND IN THE PRESENCE OF A TITANIUM COMPOUND AND GRIGNARD REAGENT TO OBTAIN ORGANOTITANIUM COMPOUND Sato, Fumie (JP) 2004-06-01 US disclosed
US-20030096996-A1 Process for producing organotitanium compound and process for addition reaction NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-05-22 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 (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-20040167344-A1 Process for producing organotitanium compound and process for addition reaction ZYX, H1-4, GRIA4 PPARA 4040/4885PPARG 2850/4885HPSE 2315/4885
US-20030096996-A1 Process for producing organotitanium compound and process for addition reaction ZYX, H1-4, GRIA4 PPARA 4040/4885PPARG 2850/4885HPSE 2315/4885

“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.