SCHEMBL21700367

SCHEMBL21700367

COC1CC[C](c2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 13/20 0.46
SLC6A4 P31645 7/20 0.46
AHR P35869 1/20 0.43
ACACB O00763 1/20 0.43
ACACA Q13085 1/20 0.43
MAPK10 P53779 3/20 0.40
SLC6A2 P23975 4/20 0.40
MAPK8 P45983 1/20 0.40
MAPK9 P45984 1/20 0.40
MAPK14 Q16539 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
SCHEMBL15855977 0.82 AHR (0.46) SLC6A3SLC6A4AHRACACBACACA
SCHEMBL28148653 0.81 SLC6A3 (0.42) SLC6A3SLC6A4AHRACACBACACA
SCHEMBL21700369 0.78 SLC6A3 (0.50) SLC6A3SLC6A4AHRSLC6A2
SCHEMBL9870874 0.77 AHR (0.65) SLC6A3AHRSLC6A2
SCHEMBL6075718 0.77 AHR (0.48) SLC6A3SLC6A4AHRSLC6A2
SCHEMBL21700368 0.77 AHR (0.48) SLC6A3SLC6A4AHRSLC6A2
SCHEMBL6472818 0.73 AHR (0.59) SLC6A3SLC6A4AHRSLC6A2
SCHEMBL8927764 0.72 ERN1 (0.42)
SCHEMBL4808905 0.71 AHR (0.56) SLC6A3AHRSLC6A2
SCHEMBL27997002 0.68 AHR (0.52) SLC6A3SLC6A4AHRSLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10562878-B2 Cycloalkylamines as monoamine reuptake inhibitors SUNOVION PHARAMCEUTICALS INC. (US) 2020-02-18 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-10562878-B2 Cycloalkylamines as monoamine reuptake inhibitors SLC18A2, SLC6A2, SLC18A3 SLC6A3 4/4885SLC6A4 5/4885AHR 649/4885

“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.