SCHEMBL22802470

SCHEMBL22802470

CCCCCCCCCCC(CCCCCCCC)CCOC(=O)COCCOCC(C)OC

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.36
DGKA P23743 1/20 0.36
ZDHHC7 Q9NXF8 1/20 0.36
CES2 O00748 1/20 0.36
MAPT P10636 1/20 0.35
FAAH O00519 5/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
ATM Q13315 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
PLA2G2C Q5R387 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
SCHEMBL22802501 1.00 NAAA (0.36) NAAADGKAZDHHC7CES2MAPT
SCHEMBL22802484 0.95 PRSS1 (0.39) NAAADGKAZDHHC7CES2MAPT
SCHEMBL22802514 0.95 PRSS1 (0.39) NAAADGKAZDHHC7CES2MAPT
SCHEMBL22802520 0.90 PRSS1 (0.36) NAAADGKAZDHHC7MAPTFAAH
SCHEMBL22802497 0.90 PRSS1 (0.36) NAAADGKAZDHHC7MAPTFAAH
SCHEMBL22802527 0.85 NAAA (0.41) NAAADGKAZDHHC7CES2FAAH
SCHEMBL22802488 0.85 NAAA (0.41) NAAADGKAZDHHC7CES2FAAH
SCHEMBL22802482 0.84 NAAA (0.40) NAAADGKAZDHHC7CES2PRSS1
SCHEMBL22802513 0.84 NAAA (0.40) NAAADGKAZDHHC7CES2PRSS1
SCHEMBL22802433 0.82 CES2 (0.41) NAAADGKAZDHHC7CES2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200399197-A1 Glycol Ether Ester Compounds Useful In Lubricating Oil Compositions And Methods Of Making Same EXXONMOBIL RES & ENG CO (US) 2020-12-24 US claimed

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-20200399197-A1 Glycol Ether Ester Compounds Useful In Lubricating Oil Compositions And Methods Of Making Same DEGS1, EBP, GK NAAA 783/4885DGKA 24/4885ZDHHC7 218/4885

“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.