SCHEMBL21609609

SCHEMBL21609609

CN1C(=O)c2cccc3c(C#Cc4cccc5ccccc45)ccc(c23)C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.54
▸ MEN1 O00255 5/20 0.54
▸ USP2 O75604 5/20 0.54
▸ KEAP1 Q14145 4/20 0.54
▸ NFE2L2 Q16236 4/20 0.54
▸ KDM4E B2RXH2 4/20 0.54
▸ ALDH1A1 P00352 4/20 0.54
▸ ATM Q13315 2/20 0.54
▸ HPGD P15428 1/20 0.54
▸ POLB P06746 3/20 0.51
▸ PRMT1 Q99873 1/20 0.51
▸ GRM5 P41594 1/20 0.42
▸ CHAT P28329 1/20 0.41
▸ CASP3 P42574 1/20 0.40
▸ CYP1B1 Q16678 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PABPC1 P11940 1/20 0.38

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
SCHEMBL20735091 0.82 KMT2A (0.63) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL21609610 0.81 CHAT (0.46) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL25988462 0.80 GRM5 (0.37) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL25066288 0.79 POLB (0.38) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL13901466 0.79 KMT2A (0.59) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL20735127 0.78 KMT2A (0.71) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL12869500 0.76 KMT2A (0.73) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL20735058 0.73 KMT2A (0.65) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL20735019 0.72 KMT2A (0.63) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL26556567 0.72 MEN1 (0.53) KMT2AMEN1USP2KEAP1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037319-B2 Curable compound DAICEL CORPORATION (JP) 2024-07-16 — — US disclosed
US-12037319-B2 Curable compound DAICEL CORPORATION (JP) 2024-07-16 — — US disclosed
US-20240067777-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2024-02-29 — — US disclosed
US-20240067777-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2024-02-29 — — US disclosed
US-20240026076-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2024-01-25 — — US disclosed
US-20240026076-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2024-01-25 — — US disclosed
US-20230373916-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2023-11-23 — — US disclosed
US-20230373916-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2023-11-23 — — US disclosed
WO-2022133984-A1 CURABLE COMPOUND PRODUCT DAICEL CORPORATION (JP) 2022-06-30 — — WO disclosed
WO-2022075324-A1 CURABLE COMPOUND PRODUCT 株式会社ダイセル 2022-04-14 — — WO disclosed
US-20210253527-A1 CURABLE COMPOUND DAICEL CORPORATION (JP) 2021-08-19 — — US disclosed
WO-2021124681-A1 CURABLE COMPOSITION 株式会社ダイセル 2021-06-24 — — WO disclosed
US-11021438-B2 Curable compound DAICEL CORPORATION (JP) 2021-06-01 — — US disclosed
WO-2019244694-A1 CURABLE COMPOUND 株式会社ダイセル 2019-12-26 — — WO disclosed
WO-2019244693-A1 CURABLE COMPOSITION 株式会社ダイセル 2019-12-26 — — 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 (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-12037319-B2 Curable compound CCT5, PGA5, KDM5B KMT2A 1311/4885MEN1 2220/4885USP2 1348/4885
US-20210253527-A1 CURABLE COMPOUND CCT5, PGA5, KDM5B KMT2A 1311/4885MEN1 2220/4885USP2 1348/4885
US-20230373916-A1 CURABLE COMPOUND PRODUCT RPLP0, SSRP1, RPP30 KMT2A 1893/4885MEN1 788/4885USP2 244/4885
US-11021438-B2 Curable compound CNOT1, CCNH, ASH2L KMT2A 2200/4885MEN1 723/4885USP2 1141/4885

“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.

Send feedback