SCHEMBL10040569

SCHEMBL10040569

O=C(Oc1cccnc1)N1CCC(c2ncc(-c3ccc(F)cc3)o2)CC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.46
GPR119 Q8TDV5 2/20 0.45
TP53 P04637 2/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 1/20 0.45
TDP1 Q9NUW8 1/20 0.42
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
NAMPT P43490 1/20 0.40
CYP2C9 P11712 1/20 0.39
HDAC4 P56524 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL10040651 0.91 FAAH (0.49) FAAHGPR119CA12CA1CA2
SCHEMBL10040655 0.90 FAAH (0.44) FAAHALDH1A1
SCHEMBL1652158 0.86 GPR119 (0.45) FAAHGPR119TP53LMNAMAPT
SCHEMBL10040537 0.86 FAAH (0.45) FAAHGPR119MAPTALDH1A1
Hydrochloric Acid SCHEMBL1654917 0.85 FAAH (0.44) FAAHGPR119MAPTALDH1A1
SCHEMBL1653169 0.85 MAPT (0.52) FAAHGPR119TP53MAPTNAMPT
SCHEMBL1653357 0.84 TP53 (0.46) GPR119TP53LMNAMAPTTDP1
SCHEMBL1652962 0.82 LMNA (0.60) LMNAMAPTALDH1A1TSHRALOX15
SCHEMBL12345448 0.81 FAAH (0.42) FAAHGPR119TP53CYP2C9ALDH1A1
SCHEMBL12231313 0.79 TP53 (0.54) TP53LMNAMAPTTDP1CA12

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 6 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-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
US-20110118311-A1 AZOLE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-05-19 US disclosed
EP-2308869-A1 AZOLE COMPOUND Astellas Pharma Inc. (JP) 2011-04-13 EP 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 FAAH 1/4885GPR119 159/4885TP53 4817/4885

“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.