SCHEMBL13079593

SCHEMBL13079593

Cc1ccc(C(C)C(=O)N(C)CC[C@H](Oc2ccc(C(F)(F)F)cc2)c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A9 P48067 13/20 0.64
▸ SLC6A4 P31645 4/20 0.62
▸ HRH3 Q9Y5N1 2/20 0.62
▸ SLC6A2 P23975 3/20 0.51
▸ SLC6A3 Q01959 3/20 0.51
▸ KCNK2 O95069 2/20 0.51
▸ KCNH2 Q12809 2/20 0.51
▸ CACNA1C Q13936 2/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ CYP2D6 P10635 2/20 0.51
▸ CYP2C19 P33261 2/20 0.51
▸ MTOR P42345 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ ALOX15 P16050 1/20 0.51

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
SCHEMBL13080690 1.00 SLC6A9 (0.64) SLC6A9SLC6A4HRH3SLC6A2SLC6A3
SCHEMBL13080691 1.00 SLC6A9 (0.64) SLC6A9SLC6A4HRH3SLC6A2SLC6A3
SCHEMBL13080692 1.00 SLC6A9 (0.64) SLC6A9SLC6A4HRH3SLC6A2SLC6A3
SCHEMBL13079592 1.00 SLC6A9 (0.64) SLC6A9SLC6A4HRH3SLC6A2SLC6A3
SCHEMBL13079594 1.00 SLC6A9 (0.64) SLC6A9SLC6A4HRH3SLC6A2SLC6A3
SCHEMBL13050312 0.96 SLC6A9 (0.69) SLC6A9SLC6A4HRH3SLC6A2SLC6A3
SCHEMBL13050299 0.96 SLC6A9 (0.69) SLC6A9SLC6A4HRH3SLC6A2SLC6A3
SCHEMBL13050304 0.96 SLC6A9 (0.69) SLC6A9SLC6A4HRH3SLC6A2SLC6A3
SCHEMBL13050309 0.96 SLC6A9 (0.69) SLC6A9SLC6A4HRH3SLC6A2SLC6A3
SCHEMBL13050308 0.96 SLC6A9 (0.69) SLC6A9SLC6A4HRH3SLC6A2SLC6A3

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-20100292289-A1 TREATMENT OF METABOLIC SYNDROME WITH NOVEL AMIDES AMPLA PHARMACEUTICALS INC. (US) 2010-11-18 — — 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-20100292289-A1 TREATMENT OF METABOLIC SYNDROME WITH NOVEL AMIDES GPR119, CPT1A, GLS2 SLC6A9 2998/4885SLC6A4 1007/4885HRH3 1429/4885

“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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