SCHEMBL6359374

SCHEMBL6359374

Cc1cccc(F)c1C(=O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.56
CES1 P23141 4/20 0.56
ACHE P22303 1/20 0.43
BCHE P06276 1/20 0.41
TDP1 Q9NUW8 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 1/20 0.39
ALB P02768 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HDAC4 P56524 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL10442141 0.85 CES2 (0.76) CES2CES1BCHETDP1LMNA
SCHEMBL31465684 0.85 L3MBTL1 (0.47) CES2CES1TDP1L3MBTL1LMNA
SCHEMBL31459315 0.83 CES2 (0.54) CES2CES1ACHETDP1L3MBTL1
SCHEMBL544028 0.83 CES2 (0.54) CES2CES1ACHETDP1L3MBTL1
Hydrochloric Acid SCHEMBL30676276 0.82 CES2 (0.52) CES2CES1ACHETDP1L3MBTL1
SCHEMBL6357822 0.79 CES2 (0.50) CES2CES1ACHEHDAC4MEN1
SCHEMBL11476973 0.79 CES2 (0.54) CES2CES1ACHEBCHETDP1
SCHEMBL12160758 0.79 CES2 (0.54) CES2CES1ACHETDP1L3MBTL1
SCHEMBL28272899 0.78 CES2 (0.48) CES2CES1ACHETDP1L3MBTL1
SCHEMBL29766383 0.78 CES2 (0.52) CES2CES1ACHETDP1L3MBTL1

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-20050124498-A1 Halobenzyl substituted phenylaceto esters and amides and use thereof for prevention of harmful organisms BAYER CROPSCIENCE AG (DE) 2005-06-09 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-20050124498-A1 Halobenzyl substituted phenylaceto esters and amides and use thereof for prevention of harmful organisms HDHD5, GNPAT, PGLS CES2 62/4885CES1 155/4885ACHE 795/4885

“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.