SCHEMBL21179040

SCHEMBL21179040

[N-]=[N+]=NC1COc2cc(OS(=O)(=O)C(F)(F)F)ccc21

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.33
PPARG P37231 4/20 0.32
PPARD Q03181 4/20 0.32
DRD2 P14416 3/20 0.32
DRD3 P35462 3/20 0.32
HTR1D P28221 2/20 0.32
HSD11B1 P28845 1/20 0.32
DRD4 P21917 2/20 0.32
CHRM1 P11229 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
DRD1 P21728 1/20 0.31
DRD5 P21918 1/20 0.31
FFAR1 O14842 2/20 0.31
HTR1A P08908 1/20 0.31
HTR1B P28222 1/20 0.31
STS P08842 1/20 0.31

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
SCHEMBL21179038 1.00 ABCB1 (0.33) ABCB1PPARGPPARDDRD2DRD3
SCHEMBL21270522 0.77 CA2 (0.38) ABCB1PPARGPPARDDRD2DRD3
SCHEMBL21178299 0.77 PPARG (0.38) ABCB1PPARGPPARDDRD2DRD3
SCHEMBL16499628 0.77 PPARG (0.38) ABCB1PPARGPPARDDRD2DRD3
SCHEMBL21270524 0.77 CA2 (0.38) ABCB1PPARGPPARDDRD2DRD3
SCHEMBL13499146 0.76 DRD2 (0.39) DRD2DRD3HTR1DHSD11B1DRD4
SCHEMBL10011429 0.72 PPARD (0.62) PPARGPPARDFFAR1
SCHEMBL3718724 0.71 HSD11B1 (0.41) ABCB1PPARGPPARDDRD2DRD3
SCHEMBL21178545 0.71 ADRA2A (0.35) PPARGPPARDDRD2DRD3CA2
SCHEMBL21178611 0.71 ADRA2A (0.35) PPARGPPARDDRD2DRD3CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4573080-A1 INDANE AND COUMARAN DERIVATIVES AS FAST SKELETAL MUSCLE MYOSIN INHIBITORS Cytokinetics, Inc. (US) 2025-06-25 EP disclosed
US-20250059173-A1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. 2025-02-20 US disclosed
EP-4491622-A2 CARDIAC SARCOMERE INHIBITORS Cytokinetics, Inc. (US) 2025-01-15 EP disclosed
EP-3740481-B9 DIHYDROBENZOFURAN AND INDEN ANALOGS AS CARDIAC SARCOMERE INHIBITORS CYTOKINETICS INC (US) 2024-10-23 EP disclosed
US-12065436-B2 Cardiac sarcomere inhibitors CYTOKINETICS, INC. (US) 2024-08-20 US disclosed
EP-3740481-B1 DIHYDROBENZOFURAN AND INDEN ANALOGS AS CARDIAC SARCOMERE INHIBITORS CYTOKINETICS INC (US) 2024-06-26 EP disclosed
CN-117964573-A Dihydrobenzofuran and indene analogs as myocardial segment inhibitors 赛特凯恩蒂克公司 2024-05-03 CN disclosed
CN-117924208-A Dihydrobenzofuran and indene analogs as myocardial segment inhibitors 赛特凯恩蒂克公司 2024-04-26 CN disclosed
WO-2024040190-A1 INDANE AND COUMARAN DERIVATIVES AS FAST SKELETAL MUSCLE MYOSIN INHIBITORS CYTOKINETICS, INCORPORATED (US) 2024-02-22 WO disclosed
CN-111757875-B Dihydrobenzofuran and indene analogs as myocardial segment inhibitors 赛特凯恩蒂克公司 2024-01-09 CN disclosed
US-20230119665-A1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. 2023-04-20 US disclosed
US-11472796-B2 Cardiac sarcomere inhibitors CYTOKINETICS, INC. (US) 2022-10-18 US disclosed
US-20210147399-A1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. 2021-05-20 US disclosed
EP-3740481-A1 DIHYDROBENZOFURAN AND INDEN ANALOGS AS CARDIAC SARCOMERE INHIBITORS Cytokinetics, Inc. (US) 2020-11-25 EP disclosed
US-10836755-B2 Cardiac sarcomere inhibitors CYTOKINETICS, INC. (US) 2020-11-17 US disclosed
CN-111757875-A Dihydrobenzofuran and indene analogs as inotropic agents 赛特凯恩蒂克公司 2020-10-09 CN disclosed
US-20190256504-A1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. 2019-08-22 US disclosed
WO-2019144041-A1 DIHYDROBENZOFURAN AND INDEN ANALOGS AS CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. (US) 2019-07-25 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 (7 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-20230119665-A1 CARDIAC SARCOMERE INHIBITORS TNNI3, TNNT2, MYLK2 ABCB1 2270/4885PPARG 3763/4885PPARD 4274/4885
US-10836755-B2 Cardiac sarcomere inhibitors TNNI3, TNNT2, MYLK2 ABCB1 2270/4885PPARG 3763/4885PPARD 4274/4885
US-20210147399-A1 CARDIAC SARCOMERE INHIBITORS TNNI3, TNNT2, MYLK2 ABCB1 2270/4885PPARG 3763/4885PPARD 4274/4885
US-12065436-B2 Cardiac sarcomere inhibitors TNNI3, TNNT2, MYLK2 ABCB1 2270/4885PPARG 3763/4885PPARD 4274/4885
US-11472796-B2 Cardiac sarcomere inhibitors TNNI3, TNNT2, MYLK2 ABCB1 2270/4885PPARG 3763/4885PPARD 4274/4885
US-20190256504-A1 CARDIAC SARCOMERE INHIBITORS TNNI3, TNNT2, MYLK2 ABCB1 2270/4885PPARG 3763/4885PPARD 4274/4885
US-20250059173-A1 CARDIAC SARCOMERE INHIBITORS TNNI3, TNNT2, MYLK2 ABCB1 2270/4885PPARG 3763/4885PPARD 4274/4885

“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.