SCHEMBL2268374

SCHEMBL2268374

CC(C)(C)OC(=O)N1CCN(c2ccc3nnc(C(F)(F)F)n3c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.49
MAPT P10636 3/20 0.49
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PDK2 Q15119 1/20 0.46
TSHR P16473 1/20 0.46
ENPP2 Q13822 2/20 0.45
CYP2C19 P33261 1/20 0.44
ALOX5 P09917 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MET P08581 1/20 0.44
NAMPT P43490 1/20 0.43
SCN5A Q14524 1/20 0.42

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
SCHEMBL2268416 0.78 HTT (0.59) MAPTLMNAALDH1A1SMN1; SMN2HTT
SCHEMBL31588141 0.76 MAPT (0.50) GPR119MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL5573222 0.76 MAPT (0.76) GPR119MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL18318160 0.76 SCN5A (0.53) GPR119SCN5A
SCHEMBL1459696 0.76 MAPT (0.64) GPR119MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL26626588 0.76 MAPT (0.49) GPR119MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL2266249 0.74 HTT (0.61) MAPTLMNAALDH1A1SMN1; SMN2HTT
SCHEMBL31587990 0.74 NAMPT (0.57) GPR119MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL4940981 0.73 MAPT (0.61) GPR119MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL2267793 0.73 SCN5A (0.48) MAPTALDH1A1HTTSCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003649-B2 Bicyclic derivatives for use in the treatment of androgen receptor associated conditions-155 ASTRAZENECA AB (SE) 2011-08-23 US disclosed
EP-2235010-A1 BICYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF ANDROGEN RECEPTOR ASSOCIATED CONDITIONS AstraZeneca AB (SE) 2010-10-06 EP disclosed
US-20100016279-A1 BICYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF ANDROGEN RECEPTOR ASSOCIATED CONDITIONS-155 ASTRAZENECA AB (SE) 2010-01-21 US disclosed
WO-2009081197-A1 BICYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF ANDROGEN RECEPTOR ASSOCIATED CONDITIONS ASTRAZENECA AB (SE) 2009-07-02 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-20100016279-A1 BICYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF ANDROGEN RECEPTOR ASSOCIATED CONDITIONS-155 AR, NR5A1, CYP17A1 GPR119 141/4885MAPT 2987/4885LMNA 749/4885

“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.