SCHEMBL2417488

SCHEMBL2417488

CCOc1cc(CN2CCC(Nc3ccc(C(=O)O)cc3)CC2)ccc1OC

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 12/20 0.60
ALDH1A1 P00352 2/20 0.59
MAPT P10636 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
LTA4H P09960 1/20 0.58
KDM4E B2RXH2 2/20 0.57
HRH1 P35367 3/20 0.57
SSTR1 P30872 1/20 0.57
HTR2B P41595 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.55

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
SCHEMBL2419790 0.88 SSTR5 (0.61) SSTR5ALDH1A1KDM4EHRH1SSTR1
SCHEMBL2421723 0.88 SSTR5 (0.56) SSTR5ALDH1A1MAPTSMN1; SMN2NPSR1
SCHEMBL2418355 0.84 SSTR5 (0.59) SSTR5ALDH1A1KDM4EHRH1SSTR1
SCHEMBL2418311 0.83 SSTR5 (0.57) SSTR5ALDH1A1KDM4EHRH1SSTR1
SCHEMBL2420636 0.83 SSTR5 (0.55) SSTR5ALDH1A1KDM4EHRH1SSTR1
SCHEMBL2418070 0.82 SSTR5 (0.56) SSTR5ALDH1A1MAPTSMN1; SMN2NPSR1
SCHEMBL2418569 0.82 SSTR5 (0.56) SSTR5ALDH1A1MAPTSMN1; SMN2NPSR1
SCHEMBL1121394 0.82 SSTR5 (0.82) SSTR5HRH1SSTR1HTR2B
SCHEMBL1877811 0.82 SSTR5 (0.66) SSTR5ALDH1A1MAPTSMN1; SMN2NPSR1
SCHEMBL25900404 0.81 SSTR5 (0.83) SSTR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8026255-B2 Substituted piperidines as somatostatin receptor subtype 5 (SSTR5) antagonists HOFFMAN-LA ROCHE INC. (US) 2011-09-27 US claimed
US-20100222350-A1 PHENYL, PYRIDINE, QUINOLINE, ISOQUINOLINE, NAPHTHYRIDINE AND PYRAZINE DERIVATIVES BINGGELI ALFRED 2010-09-02 US claimed
US-20080045544-A1 Phenyl, Pyridine, Quinoline, Isoquinoline, Naphthyridine and Pyrazine Derivatives F. HOFFMANN-LA ROCHE AG (CH) 2008-02-21 US claimed
US-8026255-B2 Substituted piperidines as somatostatin receptor subtype 5 (SSTR5) antagonists HOFFMAN-LA ROCHE INC. (US) 2011-09-27 US disclosed
US-20100222350-A1 PHENYL, PYRIDINE, QUINOLINE, ISOQUINOLINE, NAPHTHYRIDINE AND PYRAZINE DERIVATIVES BINGGELI ALFRED 2010-09-02 US disclosed
US-7754744-B2 Substituted piperidinamines as somatostatin receptor subtype 5 (SSTR5) antagonists HOFFMANN-LA ROCHE INC. (US) 2010-07-13 US disclosed
US-20080045544-A1 Phenyl, Pyridine, Quinoline, Isoquinoline, Naphthyridine and Pyrazine Derivatives F. HOFFMANN-LA ROCHE AG (CH) 2008-02-21 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 (2 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-20100222350-A1 PHENYL, PYRIDINE, QUINOLINE, ISOQUINOLINE, NAPHTHYRIDINE AND PYRAZINE DERIVATIVES SSTR5, SSTR3, SSTR1 SSTR5 1/4885ALDH1A1 2244/4885MAPT 3206/4885
US-20080045544-A1 Phenyl, Pyridine, Quinoline, Isoquinoline, Naphthyridine and Pyrazine Derivatives SSTR5, SSTR3, SSTR1 SSTR5 1/4885ALDH1A1 2244/4885MAPT 3206/4885

“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.