SCHEMBL10069540

SCHEMBL10069540

Cc1ncccc1OC(=O)N1CCC(c2nc(-c3cccc(F)c3F)n[nH]2)CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 17/20 0.41
HCRTR2 O43614 17/20 0.41
CPT2 P23786 1/20 0.39
CPT1A P50416 1/20 0.39
AKT1 P31749 1/20 0.37
AKT2 P31751 1/20 0.37
GPR119 Q8TDV5 1/20 0.36

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
SCHEMBL1654836 0.93 CPT2 (0.46) HCRTR1HCRTR2CPT2CPT1AAKT1
SCHEMBL10070556 0.88 HCRTR1 (0.42) HCRTR1HCRTR2CPT2CPT1AAKT1
SCHEMBL10070107 0.88 AKT1 (0.42) HCRTR1HCRTR2CPT2CPT1AAKT1
SCHEMBL10070512 0.86 HSD11B1 (0.42) HCRTR1HCRTR2
SCHEMBL10070076 0.86 KIT (0.44) AKT1AKT2GPR119
Hydrochloric Acid SCHEMBL1653157 0.85 HSD11B1 (0.42) HCRTR1HCRTR2
SCHEMBL10070536 0.84 CPT1A (0.46) HCRTR1HCRTR2CPT2CPT1AAKT1
SCHEMBL10070106 0.84 CPT1A (0.46) HCRTR1HCRTR2CPT2CPT1AAKT1
SCHEMBL10070550 0.84 CPT1A (0.40) HCRTR1HCRTR2CPT1AAKT1AKT2
SCHEMBL10070539 0.84 P2RY12 (0.47) HCRTR1HCRTR2GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 HCRTR1 314/4885HCRTR2 371/4885CPT2 2583/4885

“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.