SCHEMBL766303

SCHEMBL766303

CC(Oc1ccc(NC(=O)C(=O)N2CCN(c3ccccc3C(C)(C)C)CC2)cc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 15/20 0.57
SLC1A2 P43004 1/20 0.53
CYP1A2 P05177 1/20 0.40
GAA P10253 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
CYP2C19 P33261 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL766179 0.90 RBP4 (0.72) RBP4TRPV1CA2CA9
SCHEMBL766186 0.83 RBP4 (0.58) RBP4SLC1A2CYP1A2CYP2C9CYP2C19
SCHEMBL766169 0.83 RBP4 (0.69) RBP4PKM
SCHEMBL630989 0.82 RBP4 (0.57) RBP4SLC1A2
SCHEMBL766190 0.82 RBP4 (0.65) RBP4SLC1A2TRPV1CA2CA9
SCHEMBL766472 0.80 RBP4 (0.54) RBP4SLC1A2CYP1A2CYP2C9CYP2C19
SCHEMBL766200 0.78 RBP4 (0.59) RBP4SLC1A2GAA
SCHEMBL630953 0.77 RBP4 (0.54) RBP4SLC1A2GAA
SCHEMBL30996934 0.74 RBP4 (1.00) RBP4
SCHEMBL630501 0.74 RBP4 (1.00) RBP4

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-20120071489-A1 DERIVATIVES OF N-ACYL-N'-PHENYLPIPERAZINE USEFUL (INTER ALIA) FOR THE PROPHYLAXIS OR TREATMENT OF DIABETES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-22 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-20120071489-A1 DERIVATIVES OF N-ACYL-N'-PHENYLPIPERAZINE USEFUL (INTER ALIA) FOR THE PROPHYLAXIS OR TREATMENT OF DIABETES RBP4, RBP1, FABP4 RBP4 1/4885SLC1A2 2272/4885CYP1A2 2852/4885

“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.