SCHEMBL17057377

SCHEMBL17057377

COc1cccc2c1OCCC2NC(=O)C(C)(C)COc1cccc2nc(C)c(C(=O)O)c(N)c12

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 12/20 0.37
▸ SSTR1 P30872 4/20 0.37
▸ HTR1A P08908 1/20 0.34
▸ P2RX7 Q99572 1/20 0.34
▸ TRPV1 Q8NER1 1/20 0.33
▸ HCRTR1 O43613 2/20 0.33
▸ HCRTR2 O43614 2/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ ACHE P22303 1/20 0.33

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
SCHEMBL618199 0.90 SSTR4 (0.40) SSTR4SSTR1P2RX7
SCHEMBL621576 0.86 TAS1R3 (0.46) SSTR4ACHE
SCHEMBL622154 0.82 SSTR4 (0.50) SSTR4SSTR1
SCHEMBL621967 0.82 SSTR4 (0.38) SSTR4SSTR1P2RX7
SCHEMBL21281237 0.81 TAS1R3 (0.41) SSTR4SSTR1
SCHEMBL626629 0.81 SSTR4 (0.48) SSTR4SSTR1
SCHEMBL619016 0.81 SSTR4 (0.48) SSTR4SSTR1
SCHEMBL627248 0.80 SSTR4 (0.48) SSTR4SSTR1
SCHEMBL626291 0.80 SSTR4 (0.48) SSTR4SSTR1
SCHEMBL619254 0.80 SSTR4 (0.48) SSTR4SSTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10244779-B2 Method of improving stability of sweet enhancer and composition containing stabilized sweet enhancer SENOMYX, INC. (US) 2019-04-02 — — US disclosed
US-9902737-B2 Sweet flavor modifier SENOMYX, INC. (US) 2018-02-27 — — US disclosed
US-20160251372-A1 SWEET FLAVOR MODIFIER FIRMENICH INCORPORATED 2016-09-01 — — US disclosed
US-20150245642-A1 METHOD OF IMPROVING STABILITY OF SWEET ENHANCER AND COMPOSITION CONTAINING STABILIZED SWEET ENHANCER FIRMENICH INCORPORATED 2015-09-03 — — 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 (3 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-10244779-B2 Method of improving stability of sweet enhancer and composition containing stabilized sweet enhancer TFEB, TREH, SLC2A8 SSTR4 2147/4885SSTR1 2142/4885HTR1A 4395/4885
US-20150245642-A1 METHOD OF IMPROVING STABILITY OF SWEET ENHANCER AND COMPOSITION CONTAINING STABILIZED SWEET ENHANCER TFEB, TREH, SLC2A8 SSTR4 2147/4885SSTR1 2142/4885HTR1A 4395/4885
US-20160251372-A1 SWEET FLAVOR MODIFIER TAS2R5, TAS2R10, TAS2R50 SSTR4 156/4885SSTR1 192/4885HTR1A 2609/4885

“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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