SCHEMBL9909022

SCHEMBL9909022

OC1CCN(CC(Cc2ccccc2)NCCCc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 10/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
KCNA3 P22001 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
SPHK1 Q9NYA1 1/20 0.40

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
SCHEMBL9906624 0.83 NPC1 (0.45) KCNA3
SCHEMBL9909025 0.76 MEN1 (0.48) MEN1KMT2ASPHK1
SCHEMBL9906623 0.75 RAB9A (0.62) MEN1KMT2A
SCHEMBL7983946 0.73 SIGMAR1 (0.70) SIGMAR1MEN1KMT2ASPHK1
SCHEMBL7363763 0.73 SLC6A4 (0.50) MEN1KMT2AKCNA3SLC6A2SLC6A4
SCHEMBL7363761 0.73 SLC6A4 (0.50) MEN1KMT2AKCNA3SLC6A2SLC6A4
SCHEMBL7363758 0.73 SLC6A4 (0.50) MEN1KMT2AKCNA3SLC6A2SLC6A4
SCHEMBL10438853 0.72 SIGMAR1 (0.69) SIGMAR1MEN1KMT2ASPHK1
SCHEMBL9906594 0.72 FAAH (0.45) SIGMAR1
SCHEMBL9906703 0.71 SLC6A2 (0.47) SIGMAR1SLC6A2SLC6A4SLC6A3

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 5 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-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 SIGMAR1 4498/4885MEN1 952/4885KMT2A 2342/4885

“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.