SCHEMBL766232

SCHEMBL766232

C=C(C)c1ccc(N2CCN(C(=O)C(=O)O)C(CC)C2)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 5/20 0.40
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RARA P10276 3/20 0.33
RARB P10826 3/20 0.33
RARG P13631 3/20 0.33
HSD11B1 P28845 3/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
LMNA P02545 1/20 0.32
PAX8 Q06710 1/20 0.32
TSHR P16473 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
SCHEMBL766118 0.85 RBP4 (0.43) RBP4MAPTMEN1KMT2AALDH1A1
SCHEMBL766203 0.84 RBP4 (0.56) RBP4MAPTMEN1KMT2AALDH1A1
SCHEMBL766175 0.84 RBP4 (0.47) RBP4MAPTMEN1KMT2AALDH1A1
SCHEMBL766126 0.83 RBP4 (0.41) RBP4MAPTMEN1KMT2AALDH1A1
SCHEMBL766213 0.82 RBP4 (0.40) RBP4MAPTALDH1A1LMNATSHR
SCHEMBL766210 0.80 RBP4 (0.61) RBP4MEN1KMT2AALDH1A1RARA
SCHEMBL631287 0.77 RBP4 (0.34) RBP4MAPTMEN1KMT2AALDH1A1
SCHEMBL3721739 0.73 RBP4 (0.31) RBP4MAPTMEN1KMT2AALDH1A1
SCHEMBL631288 0.72 PKM (0.50) RBP4MAPTMEN1KMT2AALDH1A1
SCHEMBL3727439 0.68 RBP4 (0.36) RBP4MAPTMEN1KMT2AALDH1A1

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 1/4885MAPT 4129/4885MEN1 3929/4885

“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.