SCHEMBL1915936

SCHEMBL1915936

O=C(O)C1CCCCC1C(=O)Nc1nc(-c2ccccc2)c(-c2ccccc2)s1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
RAB9A P51151 2/20 0.56
XIAP P98170 1/20 0.54
PTGS2 P35354 2/20 0.52
ALDH1A1 P00352 4/20 0.52
KMT2A Q03164 3/20 0.52
MAPT P10636 2/20 0.52
MEN1 O00255 2/20 0.52
ADORA2A P29274 3/20 0.52
ADORA1 P30542 3/20 0.52
KDM4E B2RXH2 3/20 0.50
GAA P10253 1/20 0.50
HPGD P15428 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
USP2 O75604 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL1916165 0.86 ALDH1A1 (0.60) LMNARAB9AXIAPALDH1A1KMT2A
SCHEMBL2752611 0.86 ADORA1 (0.64) LMNAXIAPPTGS2ALDH1A1KMT2A
SCHEMBL1915242 0.85 POLB (0.55) LMNAXIAPPTGS2ALDH1A1KMT2A
SCHEMBL2754027 0.85 ADORA1 (0.63) LMNAXIAPPTGS2ALDH1A1KMT2A
SCHEMBL1914796 0.84 ALDH1A1 (0.62) LMNARAB9AALDH1A1KMT2AMAPT
SCHEMBL1849285 0.83 ADORA2A (0.55) LMNARAB9AALDH1A1KMT2AMAPT
SCHEMBL1850220 0.83 ADORA2A (0.55) LMNARAB9AALDH1A1KMT2AMAPT
SCHEMBL2754017 0.83 ADORA2A (0.70) LMNAXIAPPTGS2ALDH1A1KMT2A
SCHEMBL1915268 0.81 MEN1 (0.68) LMNAALDH1A1KMT2AMAPTMEN1
SCHEMBL3766068 0.78 ADORA2A (0.50) LMNARAB9AKMT2AMEN1ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-09-22 US claimed
EP-2364297-A1 Compounds, pharmaceutical composition and methods for use in treating metabolic disorders Euroscreen S.A. (BE) 2011-09-14 EP claimed
WO-2011076734-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING INFLAMMATORY DISEASES EUROSCREEN S.A. (BE) 2011-06-30 WO claimed
WO-2011076732-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING GASTROINTESTINAL DISORDERS EUROSCREEN S.A. (BE) 2011-06-30 WO claimed
WO-2010066682-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2010-06-17 WO claimed
US-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-09-22 US disclosed
EP-2364297-A1 Compounds, pharmaceutical composition and methods for use in treating metabolic disorders Euroscreen S.A. (BE) 2011-09-14 EP disclosed
WO-2011076734-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING INFLAMMATORY DISEASES EUROSCREEN S.A. (BE) 2011-06-30 WO disclosed
WO-2011076732-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING GASTROINTESTINAL DISORDERS EUROSCREEN S.A. (BE) 2011-06-30 WO disclosed
WO-2010066682-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2010-06-17 WO 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-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS CPT1A, LIPC, PC LMNA 2376/4885RAB9A 1681/4885XIAP 4407/4885

“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.