SCHEMBL6434563

SCHEMBL6434563

CCCCC/C=C/C=C/c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.52
ALDH1A1 P00352 2/20 0.46
TSHR P16473 1/20 0.46
FASN P49327 1/20 0.44
TDP1 Q9NUW8 2/20 0.43
FAAH O00519 3/20 0.43
EGFR P00533 1/20 0.43
SOAT2 O75908 1/20 0.42
SOAT1 P35610 1/20 0.42
LMNA P02545 2/20 0.41
TRPA1 O75762 1/20 0.41
ALOX5 P09917 1/20 0.41
MAPK1 P28482 1/20 0.41
EPHX2 P34913 2/20 0.40
HDAC3 O15379 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL6434566 1.00 MAOB (0.52) MAOBALDH1A1TSHRFASNTDP1
SCHEMBL10696596 0.98 MAOB (0.50) MAOBALDH1A1TSHRFASNTDP1
SCHEMBL3249161 0.98 MAOB (0.50) MAOBALDH1A1TSHRFASNTDP1
SCHEMBL28725214 0.98 MAOB (0.50) MAOBALDH1A1TSHRFASNTDP1
SCHEMBL10696593 0.98 MAOB (0.50) MAOBALDH1A1TSHRFASNTDP1
SCHEMBL489153 0.98 MAOB (0.50) MAOBALDH1A1TSHRFASNTDP1
SCHEMBL10952213 0.94 MAOB (0.54) MAOBALDH1A1TDP1EGFRLMNA
SCHEMBL10952208 0.94 MAOB (0.54) MAOBALDH1A1TDP1EGFRLMNA
SCHEMBL714035 0.86 SIGMAR1 (0.49) FAAHEGFRSOAT2SOAT1LMNA
SCHEMBL6289216 0.86 SIGMAR1 (0.49) FAAHEGFRSOAT2SOAT1LMNA

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 MAOB 3625/4885ALDH1A1 2157/4885TSHR 4312/4885

“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.