SCHEMBL19743971

SCHEMBL19743971

O=C(O)/C=C(/Oc1ccccc1C(F)(F)F)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.48
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
MAOB P27338 4/20 0.43
MRGPRX4 Q96LA9 1/20 0.42
NFKB1 P19838 1/20 0.39
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 2/20 0.37
GAA P10253 1/20 0.37
MCL1 Q07820 1/20 0.36
NOTUM Q6P988 1/20 0.36
HPGD P15428 2/20 0.36
RBP4 P02753 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL19744045 1.00 PPARG (0.48) PPARGRXRARXRBRXRGMAOB
SCHEMBL667777 0.79 PPARG (0.51) PPARGRXRARXRBRXRGMAOB
SCHEMBL5272098 0.77 PPARG (0.49) PPARGRXRARXRBRXRGMAOB
SCHEMBL30116328 0.77 PPARG (0.49) PPARGRXRARXRBRXRGMAOB
SCHEMBL19744074 0.77 SMN1; SMN2 (0.46) ATMTDP1LMNAHPGDKDM4E
SCHEMBL4986897 0.77 ALDH1A1 (0.40) LMNAHPGDKDM4EMAPTSMN1; SMN2
SCHEMBL19743940 0.77 SMN1; SMN2 (0.46) ATMTDP1LMNAHPGDKDM4E
SCHEMBL4986903 0.77 ALDH1A1 (0.40) LMNAHPGDKDM4EMAPTSMN1; SMN2
SCHEMBL14263873 0.77 PPARG (0.44) PPARGRXRARXRBRXRGATM
SCHEMBL4986892 0.77 ALDH1A1 (0.40) LMNAHPGDKDM4EMAPTSMN1; 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109641864-B Anti-infective agents 邓迪大学 2023-04-04 CN disclosed
US-11485720-B2 Anti-infective agents UNIVERSITY OF DUNDEE (GB) 2022-11-01 US disclosed
EP-3472141-B1 ANTI-INFECTIVE AGENTS UNIV DUNDEE (GB) 2022-10-05 EP disclosed
US-20210101877-A1 ANTI-INFECTIVE AGENTS UNIVERSITY OF DUNDEE (GB) 2021-04-08 US disclosed
US-20210101877-A1 ANTI-INFECTIVE AGENTS UNIVERSITY OF DUNDEE (GB) 2021-04-08 US disclosed
US-20190225592-A1 ANTI-INFECTIVE AGENTS UNIVERSITY OF DUNDEE (GB) 2019-07-25 US disclosed
US-20190225592-A1 ANTI-INFECTIVE AGENTS UNIVERSITY OF DUNDEE (GB) 2019-07-25 US disclosed
EP-3472141-A1 ANTI-INFECTIVE AGENTS University Of Dundee (GB) 2019-04-24 EP disclosed
WO-2017221002-A1 ANTI-INFECTIVE AGENTS UNIVERSITY OF DUNDEE (GB) 2017-12-28 WO 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 (3 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-11485720-B2 Anti-infective agents C1R, RRS1, ARG1 PPARG 2155/4885RXRA 586/4885RXRB 959/4885
US-20210101877-A1 ANTI-INFECTIVE AGENTS C1R, RRS1, ARG1 PPARG 2155/4885RXRA 586/4885RXRB 959/4885
US-20190225592-A1 ANTI-INFECTIVE AGENTS C1R, ARG1, MSR1 PPARG 1927/4885RXRA 533/4885RXRB 791/4885

“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.