SCHEMBL1028690

SCHEMBL1028690

[CH2]CC(C#N)CCCCC

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
OPRM1 P35372 1/20 0.37
LMNA P02545 1/20 0.34
DNM1 Q05193 2/20 0.33
SMPD1 P17405 3/20 0.32
FDPS P14324 3/20 0.32
THRB P10828 1/20 0.32
GPR84 Q9NQS5 2/20 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
SCHEMBL3427139 0.93
SCHEMBL2800515 0.85
SCHEMBL1131040 0.85 TSHR (0.48) TSHROPRM1LMNADNM1FDPS
SCHEMBL3474884 0.84 TSHR (0.39) TSHROPRM1LMNADNM1FDPS
SCHEMBL24044418 0.82 TSHR (0.46) TSHROPRM1LMNADNM1FDPS
SCHEMBL13601912 0.82 TSHR (0.46) TSHROPRM1LMNADNM1FDPS
SCHEMBL4745188 0.82 TSHR (0.46) TSHROPRM1LMNADNM1FDPS
SCHEMBL366647 0.82 TSHR (0.46) TSHROPRM1LMNADNM1FDPS
SCHEMBL15211724 0.82 TSHR (0.46) TSHROPRM1LMNADNM1FDPS
SCHEMBL10155552 0.82 TSHR (0.46) TSHROPRM1LMNADNM1FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2274286-A1 KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING SAID COMPOUNDS, AND USE THEREOF The Procter & Gamble Company (US) 2011-01-19 EP claimed
WO-2009140451-A1 KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING SAID COMPOUNDS, AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2009-11-19 WO claimed
US-7790897-B2 Graftable hindered amine light stabilizers CIBA SPECIALTY CHEMICALS CORP. (US) 2010-09-07 US disclosed
US-20090144915-A1 Graftable hindered amine light stabilizers MEIER HANS-RUDOLF 2009-06-11 US disclosed
US-7504510-B2 Graftable hindered amine light stabilizers CIBA SPECIALTY CHEMICALS CORP. (US) 2009-03-17 US disclosed
EP-1592664-B1 GRAFTABLE HINDERED AMINE LIGHT STABILIZERS CIBA SC HOLDING AG (CH) 2006-08-23 EP disclosed
US-20060173107-A1 Graftable hindered amine light stabilizers CIBA SPECIALTY CHEMICALS CORP. 2006-08-03 US disclosed
EP-1592664-A1 GRAFTABLE HINDERED AMINE LIGHT STABILIZERS Ciba SC Holding AG (CH) 2005-11-09 EP disclosed
WO-2004072035-A1 GRAFTABLE HINDERED AMINE LIGHT STABILIZERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-08-26 WO 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-20090144915-A1 Graftable hindered amine light stabilizers IDO1, MAOA, AOX1 TSHR 3638/4885OPRM1 603/4885LMNA 3452/4885
US-20060173107-A1 Graftable hindered amine light stabilizers IDO1, MAOA, TPH1 TSHR 3853/4885OPRM1 699/4885LMNA 3349/4885

“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.