SCHEMBL2509459

SCHEMBL2509459

CCc1ccc2nc(C)c(C(=O)O)c(N)c2c1OCC(C)(C)C(=O)NC1CCOc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 7/20 0.37
▸ SSTR4 P31391 9/20 0.34
▸ SSTR1 P30872 4/20 0.34
▸ P2RX7 Q99572 1/20 0.33
▸ NTRK1 P04629 1/20 0.32

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 0.87 SSTR4 (0.40) MAPK1SSTR4SSTR1P2RX7
SCHEMBL2511940 0.82 SSTR4 (0.41) SSTR4SSTR1
SCHEMBL2512535 0.82 TAS1R3 (0.42) SSTR4
SCHEMBL2515168 0.82 SSTR4 (0.40) SSTR4SSTR1
SCHEMBL2514146 0.82 SSTR4 (0.40) SSTR4SSTR1
SCHEMBL2513236 0.82 SSTR4 (0.40) SSTR4SSTR1
SCHEMBL621967 0.81 SSTR4 (0.38) MAPK1SSTR4SSTR1P2RX7NTRK1
SCHEMBL17057377 0.79 SSTR4 (0.37) SSTR4SSTR1P2RX7
SCHEMBL2508423 0.77 MEN1 (0.33) —
SCHEMBL627058 0.76 SSTR4 (0.41) SSTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8592592-B2 Sweet flavor modifier SENOMYX, INC. (US) 2013-11-26 — — US disclosed
US-20110245353-A1 SWEET FLAVOR MODIFIER SENOMYS, INC. (US) 2011-10-06 — — 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-20110245353-A1 SWEET FLAVOR MODIFIER TAS2R5, TAS2R10, TAS2R50 MAPK1 4532/4885SSTR4 156/4885SSTR1 192/4885

“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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