SCHEMBL5680957

SCHEMBL5680957

Cc1cc(C)c(OC(=O)O)c(O)c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.38
MAPT P10636 3/20 0.38
HPGD P15428 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
GFER P55789 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LDHA P00338 1/20 0.35
LDHB P07195 1/20 0.35
KDM4E B2RXH2 3/20 0.35
HSD17B10 Q99714 2/20 0.35
HTT P42858 2/20 0.35
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
ALDH1A1 P00352 1/20 0.34
IDO1 P14902 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
SLC37A4 O43826 1/20 0.32

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
SCHEMBL5588236 0.85 TTR (0.35) CYP3A4MAPTHPGDTDP1MEN1
SCHEMBL5588951 0.83 TTR (0.34) CYP3A4MAPTHPGDTDP1MEN1
SCHEMBL5588150 0.83 HDAC1 (0.34) CYP3A4MAPTHPGDTDP1MEN1
SCHEMBL8106146 0.83 KDM4E (0.35) CYP3A4MAPTHPGDTDP1MEN1
SCHEMBL5680573 0.82 NPSR1 (0.35) CYP3A4MAPTHPGDTDP1MEN1
SCHEMBL5589682 0.82 MAPT (0.54) CYP3A4MAPTHPGDTDP1MEN1
SCHEMBL5194002 0.79 ALDH1A1 (0.41) CYP3A4MAPTHPGDTDP1KMT2A
SCHEMBL5677863 0.78 LDHA (0.36) CYP3A4MAPTHPGDTDP1LDHA
SCHEMBL5589854 0.78 TSHR (0.38) CYP3A4MAPTHPGDTDP1MEN1
SCHEMBL5676894 0.78 LDHA (0.40) NPSR1LDHALDHBPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III ZHAO BAIYI 2006-02-16 US disclosed
EP-1620447-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III Exxonmobil Chemical Patents Inc. (US) 2006-02-01 EP disclosed
WO-2003102006-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-12-11 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-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III COMT, CD69, SPR CYP3A4 1091/4885MAPT 1188/4885HPGD 2482/4885

“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.