SCHEMBL10098035

SCHEMBL10098035

COc1ccc([C@H]2c3ccc(O)c(C)c3OC[C@H]2c2ccc(O)cc2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.41
PTGS1 P23219 1/20 0.40
CYP3A4 P08684 4/20 0.38
CYP2D6 P10635 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MAPK1 P28482 1/20 0.35
PPARG P37231 3/20 0.35
PPARD Q03181 3/20 0.35
PTPN1 P18031 2/20 0.35
ALOX5 P09917 1/20 0.35
SLC10A2 Q12908 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
PPARA Q07869 1/20 0.32

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
SCHEMBL15954687 1.00 KDM1A (0.41) KDM1APTGS1CYP3A4CYP2D6MAOA
SCHEMBL2716699 1.00 KDM1A (0.41) KDM1APTGS1CYP3A4CYP2D6MAOA
SCHEMBL30362763 1.00 KDM1A (0.41) KDM1APTGS1CYP3A4CYP2D6MAOA
SCHEMBL18895899 0.94 KDM1A (0.41) KDM1APTGS1CYP3A4CYP2D6MAOA
SCHEMBL2713457 0.89 PTGS1 (0.41) PTGS1CYP3A4CYP2D6MAOAMAOB
SCHEMBL10074010 0.89 PTGS1 (0.41) PTGS1CYP3A4CYP2D6MAOAMAOB
SCHEMBL15312110 0.89 PTGS1 (0.41) PTGS1CYP3A4CYP2D6MAOAMAOB
SCHEMBL30362778 0.89 PTGS1 (0.41) PTGS1CYP3A4CYP2D6MAOAMAOB
SCHEMBL15953600 0.86 HTR2A (0.34) PTGS1CYP3A4CYP2D6PTPN1SLC6A2
SCHEMBL2731372 0.86 HTR2A (0.34) PTGS1CYP3A4CYP2D6PTPN1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12414934-B2 Combination therapies Aardvark Therapeutics, Inc. (US) 2025-09-16 US disclosed
US-12329739-B2 Isoflavonoid compounds and methods for the treatment of cancer Aardvark Therapeutic, Inc. (US) 2025-06-17 US disclosed
WO-2024137472-A2 COMBINATION THERAPIES MEI PHARMA, INC. (US) 2024-06-27 WO disclosed
US-20230372287-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER Aardvark Therapeutics, Inc. 2023-11-23 US disclosed
US-20230372287-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER Aardvark Therapeutics, Inc. 2023-11-23 US disclosed
US-20230372287-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER Aardvark Therapeutics, Inc. 2023-11-23 US disclosed
US-20230233519-A1 COMBINATION THERAPIES Aardvark Therapeutics, Inc. 2023-07-27 US disclosed
US-20230233519-A1 COMBINATION THERAPIES Aardvark Therapeutics, Inc. 2023-07-27 US disclosed
US-20230233519-A1 COMBINATION THERAPIES Aardvark Therapeutics, Inc. 2023-07-27 US disclosed
CN-116113414-A Combination therapy 梅制药公司 2023-05-12 CN disclosed
US-11583514-B2 Isoflavonoid compounds and methods for the treatment of cancer MEI PHARMA, INC. (US) 2023-02-21 US disclosed
WO-2021252776-A1 COMBINATION THERAPIES MEI PHARMA, INC. (US) 2021-12-16 WO disclosed
US-20210000790-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER Aardvark Therapeutics, Inc. 2021-01-07 US disclosed
US-20170246142-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER Aardvark Therapeutics, Inc. 2017-08-31 US disclosed
US-20170246142-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER Aardvark Therapeutics, Inc. 2017-08-31 US disclosed
US-9663484-B2 Isoflavonoid compounds and methods for the treatment of cancer MEI PHARMA, INC. (US) 2017-05-30 US disclosed
US-9663484-B2 Isoflavonoid compounds and methods for the treatment of cancer MEI PHARMA, INC. (US) 2017-05-30 US disclosed
US-20140234295-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER MARSHALL EDWARDS, INC. (US) 2014-08-21 US disclosed
US-20140234295-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER MARSHALL EDWARDS, INC. (US) 2014-08-21 US disclosed
WO-2012061409-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER MARSHALL EDWARDS, INC. (US) 2012-05-10 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 (8 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-12414934-B2 Combination therapies PCK2, PDK1, PCK1 KDM1A 2448/4885PTGS1 1926/4885CYP3A4 4003/4885
US-20210000790-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 KDM1A 3345/4885PTGS1 326/4885CYP3A4 2283/4885
US-20230233519-A1 COMBINATION THERAPIES BCL2, BAK1, BCL2L2 KDM1A 2264/4885PTGS1 1212/4885CYP3A4 4039/4885
US-11583514-B2 Isoflavonoid compounds and methods for the treatment of cancer BAX, CASP3, API5 KDM1A 3345/4885PTGS1 326/4885CYP3A4 2283/4885
US-20140234295-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 KDM1A 3345/4885PTGS1 326/4885CYP3A4 2283/4885
US-20230372287-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 KDM1A 3345/4885PTGS1 326/4885CYP3A4 2283/4885
US-20170246142-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 KDM1A 3345/4885PTGS1 326/4885CYP3A4 2283/4885
US-12329739-B2 Isoflavonoid compounds and methods for the treatment of cancer BAX, CASP3, API5 KDM1A 3345/4885PTGS1 326/4885CYP3A4 2283/4885

“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.