SCHEMBL19625354

SCHEMBL19625354

CCOc1cc(Cl)c(-c2csc(C(C)(C)C)n2)cc1Br

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.35
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
EIF4E P06730 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HTT P42858 1/20 0.30
MYC P01106 1/20 0.30
WDR5 P61964 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL19626558 0.86 MAPT (0.45) MAPTALDH1A1SMN1; SMN2L3MBTL1HTT
SCHEMBL19625334 0.78 EIF4E (0.47) MAPTALDH1A1EIF4ETP53TDP1
SCHEMBL19625522 0.76 GRM5 (0.34) MAPTALDH1A1TDP1KMT2A
SCHEMBL19625380 0.75 MAPK1 (0.37) MAPTALDH1A1SMN1; SMN2EIF4EL3MBTL1
SCHEMBL19625337 0.75 KMT2A (0.42) MAPTALDH1A1EIF4EL3MBTL1KMT2A
SCHEMBL19625333 0.75 KMT2A (0.43) MAPTALDH1A1TP53TDP1HTT
SCHEMBL19625343 0.75 CDC25A (0.41) MAPTALDH1A1EIF4E
SCHEMBL17625937 0.74 SMN1; SMN2 (0.32) MAPTSMN1; SMN2HPGDTDP1L3MBTL1
SCHEMBL19625500 0.71 KDM4E (0.43) MAPTALDH1A1HPGDTDP1HTT
SCHEMBL19625371 0.71 MAPT (0.51) MAPTALDH1A1SMN1; SMN2HPGDTDP1

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-20170334912-A1 Purine Diones As Wnt Pathway Modulators AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-11-23 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-20170334912-A1 Purine Diones As Wnt Pathway Modulators WNT1, WNT3A, CTNNB1 MAPT 4783/4885ALDH1A1 1166/4885SMN1; SMN2 4828/4885

“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.