SCHEMBL19756384

SCHEMBL19756384

COc1cc(CO)nc2nc(C(C)(C)C)nn12

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 1/20 0.37
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
DYRK1A Q13627 1/20 0.30
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 1/20 0.30

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
SCHEMBL20079326 0.79 ALDH1A1 (0.36) ALDH1A1KDM4EL3MBTL1
SCHEMBL479082 0.64 CXCR2 (0.39) CXCR2PDE4APDE4BPDE4CPDE4D
SCHEMBL22978651 0.63 CXCR2 (0.39) CXCR2ALDH1A1KDM4EL3MBTL1PDE4A
SCHEMBL9822135 0.62 TP53 (0.37) ALDH1A1KDM4EL3MBTL1
SCHEMBL15043749 0.62 RECQL (0.58) ALDH1A1KDM4E
SCHEMBL9822243 0.60 TP53 (0.33) ALDH1A1KDM4EL3MBTL1
SCHEMBL9822237 0.60 TP53 (0.33) ALDH1A1KDM4EL3MBTL1
SCHEMBL6990127 0.59 ALDH1A1 (0.46) ALDH1A1KDM4EDYRK1APDE4APDE4B
SCHEMBL9822300 0.59 RECQL (0.37) ALDH1A1KDM4E
SCHEMBL9140788 0.58 DPP4 (0.40) ALDH1A1KDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180201574-A1 INTERMEDIATE OF PREPARING HIGH-PURITY SULFONAMIDE COMPOUND ORIENTAL (LUZHOU) AGROCHEMICALS. CO., LTD. (CN) 2018-07-19 US disclosed
US-9950997-B2 Method for preparing high-purity sulfonamide compound, and intermediate of sulfonamide compound ORIENTAL LUZHOU AGROCHEMICALS CO LTD (CN) 2018-04-24 US disclosed
US-20170369429-A1 METHOD FOR PREPARING HIGH-PURITY SULFONAMIDE COMPOUND, AND INTERMEDIATE OF SULFONAMIDE COMPOUND ORIENTAL (LUZHOU) AGROCHEMICALS CO LTD (CN) 2017-12-28 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 (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-20170369429-A1 METHOD FOR PREPARING HIGH-PURITY SULFONAMIDE COMPOUND, AND INTERMEDIATE OF SULFONAMIDE COMPOUND STS, SULT1A1, SRM CXCR2 1215/4885ALDH1A1 726/4885KDM4E 2680/4885
US-20180201574-A1 INTERMEDIATE OF PREPARING HIGH-PURITY SULFONAMIDE COMPOUND STS, SULT1A1, SULT2A1 CXCR2 1982/4885ALDH1A1 468/4885KDM4E 2823/4885

“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.