SCHEMBL21862582

SCHEMBL21862582

Cc1csc2c(C(F)(F)F)nc(O)nc12

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 1/20 0.37
▸ PARP1 P09874 1/20 0.37
▸ TNKS2 Q9H2K2 1/20 0.37
▸ NPSR1 Q6W5P4 4/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ RXFP1 Q9HBX9 4/20 0.34
▸ MAPT P10636 2/20 0.33
▸ BLM P54132 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ PDPK1 O15530 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ MALT1 Q9UDY8 1/20 0.31
▸ PIK3CA P42336 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
SCHEMBL21813906 0.80 TNKS (0.35) TNKSPARP1TNKS2NPSR1KDM4E
SCHEMBL23599247 0.78 PDPK1 (0.38) TNKSPARP1TNKS2NPSR1KDM4E
SCHEMBL5313472 0.67 PDPK1 (0.38) TNKSPARP1TNKS2NPSR1KDM4E
SCHEMBL23498442 0.67 SMN1; SMN2 (0.35) TNKSPARP1TNKS2NPSR1KDM4E
SCHEMBL19024016 0.66 KDM5B (0.32) —
SCHEMBL25393220 0.66 HTT (0.40) TNKSPARP1TNKS2NPSR1KDM4E
SCHEMBL23498507 0.65 TNKS (0.50) TNKSPARP1TNKS2NPSR1KDM4E
SCHEMBL21813942 0.65 TNKS (0.36) TNKSPARP1TNKS2KDM4EPDPK1
SCHEMBL18997486 0.65 HTT (0.39) TNKSPARP1TNKS2NPSR1KDM4E
SCHEMBL10203314 0.64 TNKS (0.38) TNKSPARP1TNKS2NPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200102324-A1 UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE GENZYME CORPORATION 2020-04-02 — — 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 (1 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-20200102324-A1 UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE MAN2B1, GAA, GBA1 TNKS 2621/4885PARP1 1274/4885TNKS2 2584/4885

“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.

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