SCHEMBL7543527

SCHEMBL7543527

O=Cc1cccc(C(O)(O)C(=O)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UNG P13051 1/20 0.54
▸ TRIM24 O15164 1/20 0.44
▸ TRIM33 Q9UPN9 1/20 0.44
▸ MAOB P27338 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ CES1 P23141 2/20 0.40
▸ NAT1 P18440 1/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SRC P12931 1/20 0.37
▸ MAOA P21397 1/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ AKR1C1 Q04828 1/20 0.36
▸ PLIN1 O60240 1/20 0.36

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
SCHEMBL7542420 0.84 UNG (0.51) UNGTRIM24TRIM33MAOBALDH1A1
SCHEMBL252920 0.78 CES1 (0.54) ALDH1A1CES1MEN1KMT2ASRC
SCHEMBL22466383 0.73 UNG (0.74) UNGTRIM24TRIM33MAOBALDH1A1
Methoxymethane SCHEMBL9792184 0.72 CES1 (0.61) ALDH1A1CES1NPC1RAB9AKMT2A
SCHEMBL1044596 0.72 UNG (0.71) UNGTRIM24TRIM33ALDH1A1CYP2A6
SCHEMBL3509619 0.72 UNG (0.46) UNGTRIM24TRIM33MAOBALDH1A1
SCHEMBL15197913 0.71 UNG (0.59) UNGTRIM24TRIM33ALDH1A1CYP2A6
3-Formylbenzoic Acid SCHEMBL266698 0.71 UNG (1.00) UNGTRIM24TRIM33ALDH1A1TDP1
3-Formylbenzoic Acid SCHEMBL29514486 0.71 UNG (1.00) UNGTRIM24TRIM33ALDH1A1TDP1
SCHEMBL17979125 0.71 KCNN4 (0.47) UNGTRIM24TRIM33ALDH1A1MEN1

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-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 — — 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-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 UNG 4414/4885TRIM24 4167/4885TRIM33 1097/4885

“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.

Send feedback