SCHEMBL20520147

SCHEMBL20520147

CCCCCCCCC(CCCCCC)C(=O)Oc1ccc(-c2ccccc2)cc1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.42
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP12 P39900 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PTGS2 P35354 1/20 0.39
PRSS1 P07477 2/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
CTSG P08311 1/20 0.39
CTRB1 P17538 1/20 0.39
CMA1 P23946 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
ICMT O60725 1/20 0.38

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
SCHEMBL20520069 1.00 PTPN11 (0.42) PTPN11MMP2MMP9MMP12ALDH1A1
SCHEMBL20520074 1.00 PTPN11 (0.42) PTPN11MMP2MMP9MMP12ALDH1A1
SCHEMBL20520016 0.99 PTPN11 (0.41) PTPN11MMP2MMP9MMP12ALDH1A1
SCHEMBL20520152 0.91 GAA (0.45) PTPN11MMP2ALDH1A1PPARGPPARA
Bromide SCHEMBL6551786 0.81 KDM4E (0.49) PTPN11KDM4EPOLBPPARGPPARA
SCHEMBL20520156 0.81 HDAC3 (0.48) MMP2MMP9MMP12ALDH1A1PRSS1
SCHEMBL20520099 0.81 HDAC3 (0.48) MMP2MMP9MMP12ALDH1A1PRSS1
SCHEMBL20519926 0.81 HDAC3 (0.48) MMP2MMP9MMP12ALDH1A1PRSS1
SCHEMBL20519807 0.80 PTGS2 (0.52) PTGS2
SCHEMBL20520028 0.80 PTGS2 (0.52) PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180282257-A1 Aromatic Monoester Compositions and Processes for Preparing Same EXXONMOBIL CHEMICAL PATENTS INC. 2018-10-04 US claimed
US-20180282257-A1 Aromatic Monoester Compositions and Processes for Preparing Same EXXONMOBIL CHEMICAL PATENTS INC. 2018-10-04 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 (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-20180282257-A1 Aromatic Monoester Compositions and Processes for Preparing Same ADH1A, ADH1C, GK PTPN11 4083/4885MMP2 4819/4885MMP9 4805/4885

“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.