SCHEMBL5760941

SCHEMBL5760941

Cc1c(OCC(F)(F)F)ccnc1C[S+]([O-])c1nc2ccccc2n1S(=O)(=O)c1ccc(OCC(=O)NCCCC(=O)O)cc1C(C)C.[NaH]

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.35
NR3C1 P04150 1/20 0.32
EGFR P00533 1/20 0.32
LMNA P02545 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
WDR5 P61964 2/20 0.30
KMT2A Q03164 2/20 0.30
ENGASE Q8NFI3 2/20 0.30
SARM1 Q6SZW1 1/20 0.30
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
DDAH1 O94760 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ATP1A1 P05023 1/20 0.30
ATP1B1 P05026 1/20 0.30
CYP1A2 P05177 1/20 0.30
GLA P06280 1/20 0.30
ABCB1 P08183 1/20 0.30
CYP3A4 P08684 1/20 0.30
ADORA3 P0DMS8 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
SCHEMBL5760967 0.99 MAPT (0.35) MAPTNR3C1EGFRLMNASMN1; SMN2
SCHEMBL5760950 0.94 MAPT (0.35) MAPTEGFRLMNASMN1; SMN2WDR5
SCHEMBL5763457 0.91 MAPT (0.40) MAPTEGFRLMNAWDR5KMT2A
SCHEMBL5763486 0.90 MAPT (0.40) MAPTEGFRLMNASMN1; SMN2WDR5
SCHEMBL5763465 0.88 MAPT (0.40) MAPTEGFRLMNASMN1; SMN2WDR5
SCHEMBL5761303 0.87 MAPT (0.38) MAPTEGFRLMNASMN1; SMN2WDR5
SCHEMBL5763751 0.86 MAPT (0.37) MAPTEGFRLMNAWDR5KMT2A
SCHEMBL5763543 0.86 HPGD (0.33) MAPTEGFRALDH1A1HPGDPSEN1
SCHEMBL5763768 0.85 MAPT (0.37) MAPTEGFRLMNAWDR5KMT2A
SCHEMBL5763795 0.83 HPGD (0.33) MAPTALDH1A1HPGDPSEN1PSEN2

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
EP-1556371-B1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS PRODRUGS OF PROTON PUMP INHIBITOR WINSTON PHARMACEUTICALS LLC (US) 2006-04-19 EP disclosed
US-20050182101-A1 Prodrugs of proton pump inhibitors GARST MICHAEL (US) 2005-08-18 US disclosed
US-20050143423-A1 Prodrugs of proton pump inhibitors background of the invention GARST MICHAEL (US) 2005-06-30 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-20050143423-A1 Prodrugs of proton pump inhibitors background of the invention ABCB11, SLC10A2, SI MAPT 4128/4885NR3C1 2960/4885EGFR 2473/4885
US-20050182101-A1 Prodrugs of proton pump inhibitors ABCB11, SLC10A2, SI MAPT 4098/4885NR3C1 2738/4885EGFR 3480/4885

“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.