SCHEMBL30645540

SCHEMBL30645540

Cc1cc2occ(CN(C)CCN(C)Cc3cn(-c4cccc(C(F)(F)F)c4)c4ccccc34)c(=O)c2cc1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TNF P01375 13/20 1.00
▸ TNFSF11 O14788 11/20 1.00
▸ TNFRSF1A P19438 1/20 1.00

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
SCHEMBL29477172 1.00 TNF (1.00) TNFTNFSF11TNFRSF1A
SCHEMBL1270919 1.00 TNF (1.00) TNFTNFSF11TNFRSF1A
SCHEMBL15159836 0.90 TNF (0.81) TNFTNFSF11TNFRSF1A
SCHEMBL21162208 0.89 TNF (0.80) TNFTNFSF11TNFRSF1A
SCHEMBL15158389 0.89 TNF (0.79) TNFTNFSF11TNFRSF1A
SCHEMBL15832294 0.89 TNF (0.79) TNFTNFSF11TNFRSF1A
SCHEMBL15832298 0.88 TNF (0.78) TNFTNFSF11TNFRSF1A
SCHEMBL15159837 0.87 TNF (0.76) TNFTNFSF11TNFRSF1A
SCHEMBL20975834 0.85 TNF (0.74) TNFTNFSF11TNFRSF1A
SCHEMBL19654771 0.85 TNF (0.74) TNFTNFSF11TNFRSF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230414560-A1 COMPOSITIONS AND METHODS FOR TREATING ECZEMA General Nutraceutical Technology LLC 2023-12-28 — — 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-20230414560-A1 COMPOSITIONS AND METHODS FOR TREATING ECZEMA ELANE, TSLP, EPX TNF 523/4885TNFSF11 4116/4885TNFRSF1A 3822/4885

“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.

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