SCHEMBL21652836

SCHEMBL21652836

CCOC(=O)c1cc2c(-c3cc(N=S(C)(C)=O)ccc3Oc3c(C)cc(F)cc3C)cn(C)c(=O)c2[nH]1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.61
BRD2 P25440 1/20 0.57
KCNH2 Q12809 1/20 0.57
BRD3 Q15059 1/20 0.57
BRDT Q58F21 1/20 0.57

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
SCHEMBL21652756 0.91 BRD4 (0.60) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL23403851 0.89 BRD4 (0.77) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL24630351 0.88 BRD4 (0.70) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL25249935 0.87 BRD4 (0.80) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL30498808 0.87 BRD4 (0.80) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL23403828 0.86 BRD4 (0.65) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL21652829 0.86 BRD4 (0.74) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL21652758 0.84 BRD4 (0.62) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL25809353 0.83 BRD4 (0.81) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL21652801 0.81 BRD4 (0.61) BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030880-B2 Iminosulfanone compound as bromodomain protein inhibitor and pharmaceutical composition and medical use thereof CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-07-09 US disclosed
US-20210300923-A1 SULFOXIMINE COMPOUND AS BROMODOMAIN PROTEIN INHIBITOR AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-09-30 US disclosed
EP-3828183-A1 SULFOXIMINE COMPOUND AS BROMODOMAIN PROTEIN INHIBITOR AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2021-06-02 EP disclosed
WO-2020020288-A1 SULFOXIMINE COMPOUND AS BROMODOMAIN PROTEIN INHIBITOR AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF 正大天晴药业集团股份有限公司 2020-01-30 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 (2 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-20210300923-A1 SULFOXIMINE COMPOUND AS BROMODOMAIN PROTEIN INHIBITOR AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF BRD1, BRD4, BRD2 BRD4 2/4885BRD2 3/4885KCNH2 4626/4885
US-12030880-B2 Iminosulfanone compound as bromodomain protein inhibitor and pharmaceutical composition and medical use thereof BRD4, BRD1, BRD3 BRD4 1/4885BRD2 5/4885KCNH2 2522/4885

“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.