SCHEMBL21829475

SCHEMBL21829475

CCC1(C(=O)ONCc2ccc(C(F)(F)F)cc2)CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
RORC P51449 7/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TACR1 P25103 3/20 0.38
GPR119 Q8TDV5 2/20 0.38
MEN1 O00255 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 1/20 0.37
TGFBR1 P36897 1/20 0.36
P2RX7 Q99572 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL21777927 0.87 P2RX7 (0.38) P2RX7PPARGPPARA
SCHEMBL21830210 0.82 MAPT (0.44) MAPTRORCSMN1; SMN2HTTNPSR1
SCHEMBL28564086 0.77 RORC (0.39) MAPTRORCSMN1; SMN2HTTNPSR1
SCHEMBL21777896 0.77 MAPT (0.46) MAPTRORCSMN1; SMN2HTTNPSR1
SCHEMBL26981969 0.77 MAPT (0.45) MAPTRORCSMN1; SMN2HTTNPSR1
SCHEMBL29588708 0.77 TEAD1 (0.47) MAPTRORCSMN1; SMN2HTTNPSR1
SCHEMBL28564050 0.76 SMN1; SMN2 (0.49) MAPTSMN1; SMN2HTTNPSR1MEN1
SCHEMBL25591485 0.73 USP2 (0.44) SMN1; SMN2
SCHEMBL21788887 0.72 MAPT (0.47) MAPTRORCSMN1; SMN2HTTNPSR1
SCHEMBL29789103 0.72 MAPT (0.47) MAPTRORCSMN1; SMN2HTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11952381-B2 Cardiac sarcomere inhibitors CYTOKINETICS, INC. (US) 2024-04-09 US disclosed
US-20230090256-A1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. 2023-03-23 US disclosed
US-11414424-B2 Cardiac sarcomere inhibitors CYTOKINETICS, INC. (US) 2022-08-16 US disclosed
CN-112867539-A Cardiac muscle segment inhibitor 赛特凯恩蒂克公司 2021-05-28 CN disclosed
US-20200109148-A1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. 2020-04-09 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 (4 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-11414424-B2 Cardiac sarcomere inhibitors TNNI3, MYLK2, TNNT2 MAPT 2089/4885RORC 4575/4885SMN1; SMN2 96/4885
US-20200109148-A1 CARDIAC SARCOMERE INHIBITORS TNNI3, MYLK2, TNNT2 MAPT 2089/4885RORC 4575/4885SMN1; SMN2 96/4885
US-20230090256-A1 CARDIAC SARCOMERE INHIBITORS TNNI3, MYLK2, TNNT2 MAPT 2089/4885RORC 4575/4885SMN1; SMN2 96/4885
US-11952381-B2 Cardiac sarcomere inhibitors TNNI3, MYLK2, TNNT2 MAPT 2089/4885RORC 4575/4885SMN1; SMN2 96/4885

“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.