SCHEMBL6098573

SCHEMBL6098573

Clc1ccc(C2(OCc3c(Cl)cccc3Cl)CCNCC2OCc2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A3 Q01959 2/20 0.38
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
TACR1 P25103 2/20 0.34
REN P00797 2/20 0.32

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
SCHEMBL6093955 1.00 SLC6A4 (0.38) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL6109049 0.90 SLC6A2 (0.37) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL6095547 0.90 SLC6A2 (0.37) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL6096924 0.87 SLC6A4 (0.36) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL6095814 0.87 SLC6A4 (0.36) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL6094320 0.86 SLC6A4 (0.36) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL6093000 0.86 SLC6A4 (0.36) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL6094493 0.86 SLC6A2 (0.40) SLC6A4SLC6A2SLC6A3
SCHEMBL6094486 0.86 SLC6A2 (0.40) SLC6A4SLC6A2SLC6A3
SCHEMBL6095669 0.86 SLC6A2 (0.37) SLC6A4SLC6A2SLC6A3HTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7060713-B2 Substituted piperidines HOFFMANN-LA ROCHE INC. (US) 2006-06-13 US disclosed
US-20050171157-A1 3-alkyl- or alkenyloxy-4-phenyl-4-phenylalkoxypiperidines that may be N-substituted, e.g., cis-[rac]-4-Benzyloxy-4-(4-fluoro-phenyl)-3-butyloxy-piperidine; treating breast or colon cancer KIM KYUNGJIN (US) 2005-08-04 US disclosed
US-6916833-B2 Substituted piperidines HOFFMANN-LA ROCHE INC. (US) 2005-07-12 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-20050171157-A1 3-alkyl- or alkenyloxy-4-phenyl-4-phenylalkoxypiperidines that may be N-substituted, e.g., cis-[rac]-4-Benzyloxy-4-(4-fluoro-phenyl)-3-butyloxy-piperidine; treating breast or colon cancer KRAS, TMEM205, ABCB11 SLC6A4 425/4885SLC6A2 515/4885SLC6A3 1729/4885

“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.