SCHEMBL6873016

SCHEMBL6873016

CN1C(C)(C)CCC(OC(=O)CC(C(=O)OC2CCC(C)(C)N(C)C2(C)C)C(CC(=O)OC2CCC(C)(C)N(C)C2(C)C)C(=O)OC2CCC(C)(C)N(C)C2(C)C)C1(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.30
NFKB1 P19838 1/20 0.30
CYP2C19 P33261 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
SCHEMBL7176427 0.86
SCHEMBL8869611 0.82 ALDH1A1 (0.37) TSHRNFKB1CYP2C19
SCHEMBL8147768 0.80 SMN1; SMN2 (0.37)
SCHEMBL114192 0.78 NAAA (0.40)
SCHEMBL4223230 0.74 CETP (0.37)
SCHEMBL4348704 0.74 NAAA (0.49)
SCHEMBL713338 0.72
SCHEMBL30795 0.71 CYP2D6 (0.35) TSHRNFKB1CYP2C19
SCHEMBL20113386 0.71 CYP2D6 (0.35) TSHRNFKB1CYP2C19
SCHEMBL2202765 0.71 TSHR (0.30) TSHRNFKB1CYP2C19

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-6835329-B2 Photostability; hindered amine light stabilizers CIBA SPECIALTY CHEMICALS CORPORATION 2004-12-28 US disclosed
US-20040013619-A1 Heteroaryl substituted hydroxyphenyltriazine uv-absorbers CIBA SPECIALTY CHEMICALS CORP. 2004-01-22 US disclosed
US-6271377-B1 Hydroxy-substituted N-alkoxy hindered amines and compositions stabilized therewith CIBA SPECIALTY CHEMICALS CORPORATION 2001-08-07 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-20040013619-A1 Heteroaryl substituted hydroxyphenyltriazine uv-absorbers CBR1, CYP4Z1, CYP1A1 TSHR 1844/4885NFKB1 1268/4885CYP2C19 49/4885

“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.