SCHEMBL21359040

SCHEMBL21359040

CCOc1ccc(CCC(=O)O)cc1F

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 10/20 0.51
FFAR1 O14842 9/20 0.51
TP53 P04637 1/20 0.48
MDM2 Q00987 1/20 0.48
LMNA P02545 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PPARG P37231 1/20 0.47
PPARD Q03181 1/20 0.47
PPARA Q07869 1/20 0.47
RXRG P48443 1/20 0.46
S1PR1 P21453 1/20 0.45
S1PR3 Q99500 1/20 0.45
S1PR5 Q9H228 1/20 0.45

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
SCHEMBL2355823 0.88 FFAR1 (0.57) FFAR4FFAR1PPARGPPARDPPARA
SCHEMBL6062457 0.88 FFAR4 (0.63) FFAR4FFAR1PPARGPPARDPPARA
SCHEMBL6062657 0.87 FFAR1 (0.56) FFAR4FFAR1PPARGPPARDPPARA
SCHEMBL2840795 0.86 FFAR4 (0.55) FFAR4FFAR1LMNAL3MBTL1
SCHEMBL6063887 0.85 FFAR4 (0.53) FFAR4FFAR1RXRG
SCHEMBL8984885 0.84 FFAR4 (0.54) FFAR4FFAR1TP53MDM2LMNA
SCHEMBL585819 0.84 FFAR4 (0.60) FFAR4FFAR1LMNAPPARDPPARA
SCHEMBL3967976 0.84 FFAR4 (0.51) FFAR4FFAR1LMNAL3MBTL1PPARG
SCHEMBL6063764 0.84 FFAR1 (0.61) FFAR4FFAR1PPARD
SCHEMBL3406479 0.84 LTB4R (0.47) FFAR1LMNAL3MBTL1PPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685725-B2 YAP1 inhibitors that target the interaction of YAP1 with OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2023-06-27 US disclosed
US-11685725-B2 YAP1 inhibitors that target the interaction of YAP1 with OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2023-06-27 US disclosed
US-20210363128-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2021-11-25 US disclosed
US-20210363128-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2021-11-25 US disclosed
EP-3765015-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 H. Lee Moffitt Cancer Center & Research Institute, Inc. (US) 2021-01-20 EP disclosed
CN-111989100-A YAP1 inhibitors targeting YAP1 interaction with OCT4 H·李·莫菲特癌症中心研究有限公司 2020-11-24 CN disclosed
WO-2019178401-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2019-09-19 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 (2 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-11685725-B2 YAP1 inhibitors that target the interaction of YAP1 with OCT4 YAP1, YES1, MYC FFAR4 4428/4885FFAR1 4636/4885TP53 121/4885
US-20210363128-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 YAP1, MYC, YES1 FFAR4 4444/4885FFAR1 4673/4885TP53 121/4885

“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.