SCHEMBL9906597

SCHEMBL9906597

COC1CCN(C(=O)[C@H](Cc2ccccc2)NCc2cccc(Oc3cccc(Cl)c3)c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.45
CYP51A1 Q16850 3/20 0.45
PYGL P06737 1/20 0.45
TACR1 P25103 5/20 0.43
CCR1 P32246 1/20 0.42
CYP3A4 P08684 1/20 0.42
UGCG Q16739 1/20 0.42
F11 P03951 1/20 0.41
GAA P10253 1/20 0.41
EPHX2 P34913 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
SCHEMBL9906595 0.81 FAAH (0.41) FAAH
SCHEMBL9906594 0.72 FAAH (0.45) FAAH
SCHEMBL9906598 0.70 HSD17B10 (0.64) GAA
SCHEMBL2376389 0.70 POLB (0.65) FAAH
SCHEMBL2376394 0.70 POLB (0.65) FAAH
SCHEMBL13540967 0.69 OPRD1 (0.60) TACR1CYP3A4
SCHEMBL17104831 0.68 MEN1 (0.61) FAAHGAA
SCHEMBL1360960 0.67 ALDH1A1 (0.55) FAAHCYP3A4
SCHEMBL1360958 0.67 ALDH1A1 (0.55) FAAHCYP3A4
SCHEMBL3117108 0.67 PPARG (0.47) FAAH

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-8198303-B2 Methods of use and compositions for the diagnosis and treatment of infectious diseases SEQUELLA, INC. (US) 2012-06-12 US disclosed
US-20100273826-A1 METHODS OF USE AND COMPOSITIONS FOR THE DIAGNOSIS AND TREATMENT OF INFECTIOUS DISEASES SEQUELLA, INC. 2010-10-28 US disclosed
US-7652039-B2 Such as 1-(2-((3-(4-chlorophenoxy)benzyl)amino)-3-phenyl-propyl)piperidin-4-ol for treatment of tuberculosis; solid phase synthesis SEQUELLA, INC. (US) 2010-01-26 US disclosed
US-7652039-B2 Such as 1-(2-((3-(4-chlorophenoxy)benzyl)amino)-3-phenyl-propyl)piperidin-4-ol for treatment of tuberculosis; solid phase synthesis SEQUELLA, INC. (US) 2010-01-26 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-20100273826-A1 METHODS OF USE AND COMPOSITIONS FOR THE DIAGNOSIS AND TREATMENT OF INFECTIOUS DISEASES C5, THPO, TERT FAAH 2618/4885CYP51A1 3817/4885PYGL 147/4885

“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.