SCHEMBL6446983

SCHEMBL6446983

CCC(=O)Oc1ccc(C(=O)O)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.49
RARA P10276 2/20 0.49
ACHE P22303 2/20 0.48
ELANE P08246 2/20 0.47
ESR1 P03372 2/20 0.47
HIF1A Q16665 2/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 2/20 0.45
MAOB P27338 3/20 0.44
ALDH1A1 P00352 2/20 0.44
RARG P13631 1/20 0.43
MAOA P21397 1/20 0.43
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
CPS1 P31327 1/20 0.41

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
SCHEMBL11776036 0.85 ALDH1A1 (0.61) ACHEELANEESR1HIF1ARECQL
SCHEMBL22279458 0.84 RARB (0.43) RARBRARAKDM4EMAOBALDH1A1
SCHEMBL25946838 0.84 RARB (0.43) RARBRARAKDM4EMAOBALDH1A1
SCHEMBL7764445 0.84 RARB (0.53) RARBRARARECQLKMT2ASMN1; SMN2
SCHEMBL1787665 0.83 KMT2A (0.53) ACHEELANEESR1HIF1ARECQL
SCHEMBL8189325 0.83 RARB (0.53) RARBRARARECQLKMT2ASMN1; SMN2
SCHEMBL7776130 0.83 RARB (0.53) RARBRARARECQLKMT2ASMN1; SMN2
SCHEMBL8203165 0.83 RARB (0.53) RARBRARARECQLKMT2ASMN1; SMN2
SCHEMBL7750630 0.83 RARB (0.53) RARBRARARECQLKMT2ASMN1; SMN2
SCHEMBL8190524 0.83 RARB (0.53) RARBRARARECQLKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1238961-B1 Process for the preparation of benzyl esters of hydroxybenzoic acids BAYER CHEMICALS AG (DE) 2005-01-26 EP disclosed
US-6600064-B2 Reacting dibenzyl ethers with alkylcarbonyloxybenzoic or alkoxycarbonyloxybenzoic acids in the presence of one or more acids as catalyst BAYER AKTIENGESELLSCHAFT (DE) 2003-07-29 US disclosed
US-20020128523-A1 Process for the preparation of hydroxybenzoic benzyl esters LANXESS DEUTSCHLAND GMBH (DE) 2002-09-12 US disclosed
EP-1238961-A1 Process for the preparation of benzyl esters of hydroxybenzoic acids Bayer Aktiengesellschaft (DE) 2002-09-11 EP 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-20020128523-A1 Process for the preparation of hydroxybenzoic benzyl esters HAAO, HPD, ALKBH3 RARB 185/4885RARA 298/4885ACHE 2917/4885

“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.