SCHEMBL16298613

SCHEMBL16298613

CCOCC/N=C(\C)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.35
NOS3 P29474 2/20 0.33
NOS1 P29475 2/20 0.33
NOS2 P35228 2/20 0.33
THRB P10828 1/20 0.31

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
SCHEMBL18949018 0.85 HSD17B10 (0.40) NOS3NOS1NOS2
SCHEMBL16173514 0.81 NOS3 (0.40) NOS3NOS1NOS2
SCHEMBL18949017 0.77
SCHEMBL75424 0.76 NOS3 (0.33) NOS3NOS1NOS2
SCHEMBL16317612 0.76
SCHEMBL4384253 0.75 HTT (0.33)
SCHEMBL13663722 0.74
SCHEMBL28618950 0.74
SCHEMBL10005250 0.71
SCHEMBL14273902 0.71

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
US-8119831-B2 Moisture activated latent curing adhesive or sealant ETHICON, INC. (US) 2012-02-21 US disclosed
US-20100087672-A1 MOISTURE ACTIVATED LATENT CURING ADHESIVE OR SEALANT ETHICON, INC. 2010-04-08 US disclosed
US-20080039547-A1 Moisture activated latent curing adhesive or sealant ETHICON, INC. 2008-02-14 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-20100087672-A1 MOISTURE ACTIVATED LATENT CURING ADHESIVE OR SEALANT ICAM1, EHMT1, EHMT2 ALDH1A1 60/4885TSHR 4853/4885NOS3 693/4885
US-20080039547-A1 Moisture activated latent curing adhesive or sealant ICAM1, EHMT1, CDH1 ALDH1A1 76/4885TSHR 4861/4885NOS3 770/4885

“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.