SCHEMBL12013236

SCHEMBL12013236

O=C1CS/C(=N\c2ccccc2)N1c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GFER P55789 1/20 0.68
▸ ALDH1A1 P00352 5/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ MAPT P10636 3/20 0.51
▸ POLB P06746 2/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ CHEK1 O14757 1/20 0.50
▸ KCNH2 Q12809 1/20 0.50
▸ TSHR P16473 1/20 0.49
▸ ALOX12 P18054 1/20 0.49
▸ EGFR P00533 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47

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
SCHEMBL28037508 1.00 GFER (0.68) GFERALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL27898212 0.90 GFER (0.63) GFERALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL3889242 0.86 L3MBTL1 (0.64) GFERALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL3889245 0.86 L3MBTL1 (0.64) GFERALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL27915949 0.85 GFER (0.55) GFERALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL31310377 0.85 CA2 (0.64) GFERALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL945889 0.81 ALDH1A1 (0.58) GFERALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL945891 0.81 ALDH1A1 (0.58) GFERALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL28177739 0.78 CA9 (0.56) GFERALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL2589792 0.78 MEN1 (0.68) GFERALDH1A1L3MBTL1MEN1KMT2A

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-8252940-B2 5-substituted-2-imino-thiazolidinone compounds and their use as inhibitors of bacterial infection UNIVERSITY OF WASHINGTON (US) 2012-08-28 — — US disclosed
US-8252940-B2 5-substituted-2-imino-thiazolidinone compounds and their use as inhibitors of bacterial infection UNIVERSITY OF WASHINGTON (US) 2012-08-28 — — US disclosed
US-20110039849-A1 5-SUBSTITUTED-2-IMINO-THIAZOLIDINONE COMPOUNDS AND THEIR USE AS INHIBITORS OF BACTERIAL INFECTION UNIVERSITY OF WASHINGTON (US) 2011-02-17 — — US disclosed
US-20110039849-A1 5-SUBSTITUTED-2-IMINO-THIAZOLIDINONE COMPOUNDS AND THEIR USE AS INHIBITORS OF BACTERIAL INFECTION UNIVERSITY OF WASHINGTON (US) 2011-02-17 — — US disclosed
WO-2009137133-A2 5-SUBSTITUTED-2-IMINO-THIAZOLIDINONE COMPOUNDS AND THEIR USE AS INHIBITORS OF BACTERIAL INFECTION UNIVERSITY OF WASHINGTON (US) 2009-11-12 — — 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 (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-20110039849-A1 5-SUBSTITUTED-2-IMINO-THIAZOLIDINONE COMPOUNDS AND THEIR USE AS INHIBITORS OF BACTERIAL INFECTION IRF3, GDI2, TLR5 GFER 4110/4885ALDH1A1 4529/4885L3MBTL1 2946/4885

“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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