SCHEMBL10098032

SCHEMBL10098032

COc1c(C)cc([C@H]2c3ccc(O)c(C)c3OC[C@H]2c2ccc(O)cc2)cc1C

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.39
CYP3A4 P08684 3/20 0.35
MAPK1 P28482 1/20 0.35
ESR1 P03372 7/20 0.34
ESR2 Q92731 7/20 0.34
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
PTPN1 P18031 1/20 0.32
CYP2D6 P10635 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
SCHEMBL2716086 1.00 PTGS1 (0.39) PTGS1CYP3A4MAPK1ESR1ESR2
SCHEMBL2716085 1.00 PTGS1 (0.39) PTGS1CYP3A4MAPK1ESR1ESR2
SCHEMBL15954206 1.00 PTGS1 (0.39) PTGS1CYP3A4MAPK1ESR1ESR2
SCHEMBL30362837 1.00 PTGS1 (0.39) PTGS1CYP3A4MAPK1ESR1ESR2
SCHEMBL30362814 0.88 ESR1 (0.36) PTGS1CYP3A4ESR1ESR2ALOX15
SCHEMBL10074001 0.88 ESR1 (0.36) PTGS1CYP3A4ESR1ESR2ALOX15
SCHEMBL15312086 0.88 ESR1 (0.36) PTGS1CYP3A4ESR1ESR2ALOX15
SCHEMBL2713088 0.88 ESR1 (0.36) PTGS1CYP3A4ESR1ESR2ALOX15
SCHEMBL2713457 0.88 PTGS1 (0.41) PTGS1CYP3A4MAPK1PTPN1CYP2D6
SCHEMBL30362778 0.88 PTGS1 (0.41) PTGS1CYP3A4MAPK1PTPN1CYP2D6

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 28 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-116139125-A Combination therapy 梅制药公司 2023-05-23 CN 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-20190142790-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER MARSHALL EDWARDS, INC. 2019-05-16 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 PTGS1 1926/4885CYP3A4 4003/4885MAPK1 938/4885
US-20210000790-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 PTGS1 326/4885CYP3A4 2283/4885MAPK1 3060/4885
US-20230233519-A1 COMBINATION THERAPIES BCL2, BAK1, BCL2L2 PTGS1 1212/4885CYP3A4 4039/4885MAPK1 3494/4885
US-20190142790-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 PTGS1 326/4885CYP3A4 2283/4885MAPK1 3060/4885
US-20140234295-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 PTGS1 326/4885CYP3A4 2283/4885MAPK1 3060/4885
US-20230372287-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 PTGS1 326/4885CYP3A4 2283/4885MAPK1 3060/4885
US-20170246142-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 PTGS1 326/4885CYP3A4 2283/4885MAPK1 3060/4885
US-12329739-B2 Isoflavonoid compounds and methods for the treatment of cancer BAX, CASP3, API5 PTGS1 326/4885CYP3A4 2283/4885MAPK1 3060/4885

“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.