SCHEMBL6434868

SCHEMBL6434868

CCCCC/C=C/c1cccs1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
HTT P42858 1/20 0.50
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
ALOX5 P09917 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
KMT2A Q03164 2/20 0.40
RAB9A P51151 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP1B1 Q16678 1/20 0.39

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
SCHEMBL6434876 1.00 MAPT (0.50) MAPTHTTALDH1A1LMNAGAA
SCHEMBL15688422 0.98 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL2007438 0.98 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL2007435 0.98 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL16135282 0.98 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL23345517 0.98 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL16135275 0.98 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL10605933 0.98 MAPT (0.49) MAPTHTTALDH1A1LMNAGAA
SCHEMBL21392011 0.95 MAPT (0.51) MAPTHTTALDH1A1LMNAGAA
SCHEMBL20634195 0.95 MAPT (0.51) MAPTHTTALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6867323-B2 Cross-coupling reaction of organosilicon nucleophiles THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2005-03-15 US disclosed
US-20020183516-A1 Cross-coupling reaction of organosilicon nucleophiles UNIVERSITY OF ILLINOIS URBANA-CHAMPAIGN 2002-12-05 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-20020183516-A1 Cross-coupling reaction of organosilicon nucleophiles TST, HPD, PCNA MAPT 4787/4885HTT 1274/4885ALDH1A1 2157/4885

“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.