SCHEMBL2207966

SCHEMBL2207966

COc1ccc(C(C)CC(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 11/20 0.56
KMT2A Q03164 2/20 0.55
ATM Q13315 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.53
ALDH1A1 P00352 1/20 0.51
TSHR P16473 1/20 0.51
HTT P42858 1/20 0.50
LDHA P00338 1/20 0.49
FFAR4 Q5NUL3 1/20 0.48

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
SCHEMBL3980530 0.88 FFAR1 (0.71) FFAR1
SCHEMBL3980533 0.88 FFAR1 (0.71) FFAR1
SCHEMBL17754960 0.85 RAB9A (0.51) KMT2AL3MBTL1ALDH1A1HTT
SCHEMBL3967988 0.85 ABCB11 (0.67) FFAR1L3MBTL1TSHR
SCHEMBL6484578 0.85 FFAR1 (0.66) FFAR1KMT2AATML3MBTL1HTT
SCHEMBL5702738 0.84 FFAR1 (0.49) FFAR1KMT2AATML3MBTL1ALDH1A1
SCHEMBL12883281 0.84 TNF (0.54) FFAR1KMT2AL3MBTL1ALDH1A1HTT
SCHEMBL2226074 0.83 L3MBTL1 (0.68) FFAR1KMT2AATML3MBTL1LDHA
SCHEMBL13140159 0.82 FFAR1 (0.64) FFAR1ALDH1A1TSHRFFAR4
SCHEMBL8476326 0.82 FFAR1 (0.53) FFAR1KMT2AL3MBTL1ALDH1A1TSHR

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233794-B1 INDENYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND MEDICAL USES THEREOF ADT PHARMACEUTICALS LLC (US) 2023-02-01 EP disclosed
US-20220315553-A1 INDENYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND MEDICAL USES THEREOF ADT PHARMACEUTICALS, LLC (US) 2022-10-06 US disclosed
US-11198679-B2 Method of treating or preventing Ras-mediated diseases ADT PHARMACEUTICALS, LLC (US) 2021-12-14 US disclosed
US-11130744-B2 Indenyl compounds, pharmaceutical compositions, and medical uses thereof ADT PHARMACEUTICALS, LLC (US) 2021-09-28 US disclosed
US-10981886-B2 Indenyl compounds, pharmaceutical compositions, and medical uses thereof ADT PHARMACEUTICALS, LLC (US) 2021-04-20 US disclosed
US-10975054-B2 Indenyl compounds, pharmaceutical compositions, and medical uses thereof ADT PHARMACEUTICALS, LLC (US) 2021-04-13 US disclosed
US-20200223816-A1 INDENYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND MEDICAL USES THEREOF ADT PHARMACEUTICALS, LLC (US) 2020-07-16 US disclosed
US-20200223815-A1 INDENYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND MEDICAL USES THEREOF ADT PHARMACEUTICALS, LLC (US) 2020-07-16 US disclosed
US-20200223817-A1 METHOD OF TREATING OR PREVENTING RAS-MEDIATED DISEASES ADT PHARMACEUTICALS, LLC (US) 2020-07-16 US disclosed
EP-3666268-A1 METHOD OF TREATING OR PREVENTING RAS-MEDIATED DISEASES ADT Pharmaceuticals, LLC (US) 2020-06-17 EP disclosed
WO-2009053443-A2 INDANE COMPOUNDS FERRER INTERNACIONAL S.A. (ES) 2009-04-30 WO disclosed
US-20070066647-A1 Conformationally constrained 3-(4-hydroxy-phenyl)-substituted-propanoic acids useful for treating metabolic disorders AMGEN ING. (US) 2007-03-22 US disclosed
US-20040186151-A1 Substituted azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2004-09-23 US disclosed
WO-2004071448-A2 SUBSTITUTED AZOLE DERIVATIVES AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASES TRANSTECH PHARMA INC. (US) 2004-08-26 WO disclosed
US-6387920-B2 ISOXAZOLE COMPOUNDS; FOR TREATING ESTROGEN RECEPTOR-MEDIATED DISORDERS SUCH AS OSTEOPOROSIS, BREAST AND ENDOMETRIAL CANCERS, ATHEROSCLEROSIS, ALZHEIMER'S DISEASE CHIRON CORPORATION 2002-05-14 US disclosed
CN-1129698-A Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1996-08-28 CN disclosed
EP-0302603-A1 Dopamine-beta-hydroxylase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1989-02-08 EP disclosed
US-4798843-A HYPOTENSIVE AGENTS SMITHKLINE BECKMAN CORPORATION (US) 1989-01-17 US disclosed
US-4273873-A BONDING SYNTHETIC FIBRINOLYTIC COMPOUND OR ENZYME UNITIKA LTD. (JP) 1981-06-16 US disclosed
US-4006243-A FUNGICIDE, BACTERICIDE, YEAST SCHERING AKTIENGESELLSCHAFT (DT) 1977-02-01 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 (10 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-20220315553-A1 INDENYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND MEDICAL USES THEREOF INSRR, INSR, BRCA1 FFAR1 1339/4885KMT2A 2861/4885ATM 1070/4885
US-20200223815-A1 INDENYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND MEDICAL USES THEREOF INSRR, INSR, BRCA1 FFAR1 1339/4885KMT2A 2861/4885ATM 1070/4885
US-11198679-B2 Method of treating or preventing Ras-mediated diseases KRAS, NRAS, HRAS FFAR1 2520/4885KMT2A 2337/4885ATM 2097/4885
US-20070066647-A1 Conformationally constrained 3-(4-hydroxy-phenyl)-substituted-propanoic acids useful for treating metabolic disorders PC, PNLIP, PDHX FFAR1 51/4885KMT2A 2325/4885ATM 4565/4885
US-11130744-B2 Indenyl compounds, pharmaceutical compositions, and medical uses thereof INSRR, INSR, BRCA1 FFAR1 1339/4885KMT2A 2861/4885ATM 1070/4885
US-10981886-B2 Indenyl compounds, pharmaceutical compositions, and medical uses thereof INSRR, INSR, BRCA1 FFAR1 1339/4885KMT2A 2861/4885ATM 1070/4885
US-20200223817-A1 METHOD OF TREATING OR PREVENTING RAS-MEDIATED DISEASES KRAS, NRAS, HRAS FFAR1 2520/4885KMT2A 2337/4885ATM 2097/4885
US-20200223816-A1 INDENYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND MEDICAL USES THEREOF INSRR, INSR, BRCA1 FFAR1 1339/4885KMT2A 2861/4885ATM 1070/4885
US-20040186151-A1 Substituted azole derivatives as therapeutic agents PTPRS, PTPRO, PTPRJ FFAR1 1810/4885KMT2A 1996/4885ATM 2862/4885
US-10975054-B2 Indenyl compounds, pharmaceutical compositions, and medical uses thereof INSRR, INSR, BRCA1 FFAR1 1339/4885KMT2A 2861/4885ATM 1070/4885

“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.