SCHEMBL10070063

SCHEMBL10070063

CC(C)(C)OC(=O)N1CCC(c2nc(-c3cc(F)cc(F)c3)n[nH]2)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.48
KDM4E B2RXH2 2/20 0.47
MAPT P10636 2/20 0.47
THRB P10828 1/20 0.47
HPGDS O60760 2/20 0.47
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CNR1 P21554 1/20 0.42
GPR119 Q8TDV5 1/20 0.41
POLB P06746 1/20 0.41
CPT1A P50416 1/20 0.41

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
SCHEMBL10070506 0.90 HPGDS (0.53) HTTKDM4EMAPTTHRBHPGDS
SCHEMBL10069708 0.89 HPGDS (0.52) HTTKDM4EMAPTTHRBHPGDS
SCHEMBL1653217 0.85 HPGDS (0.64) HTTKDM4ETHRBHPGDSMEN1
SCHEMBL1653375 0.83 CNR1 (0.53) HTTKDM4EMAPTTHRBHPGDS
SCHEMBL10070547 0.82 HPGDS (0.51) HTTKDM4EMAPTTHRBHPGDS
SCHEMBL10070098 0.81 CPT2 (0.51) HTTKDM4EMAPTTHRBHPGDS
SCHEMBL10070083 0.79 P2RY12 (0.40) HTTKDM4EMEN1KMT2AHPGD
SCHEMBL17801068 0.79 HTT (0.47) HTTKDM4EMAPTTHRBHPGDS
SCHEMBL10070093 0.79 CPT1A (0.40) CPT1A
SCHEMBL10070550 0.78 CPT1A (0.40) GPR119CPT1A

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
EP-2308869-B1 AZOLE COMPOUND ASTELLAS PHARMA INC (JP) 2012-09-19 EP disclosed
US-8207199-B2 Azole compound ASTELLAS PHARMA INC. (JP) 2012-06-26 US disclosed
US-20110118311-A1 AZOLE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-05-19 US disclosed
WO-2010007966-A1 AZOLE COMPOUND アステラス製薬株式会社 (JP) 2010-01-21 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-20110118311-A1 AZOLE COMPOUND FAAH, FAAH2, TRPV1 HTT 3242/4885KDM4E 665/4885MAPT 2507/4885

“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.