SCHEMBL23074657

SCHEMBL23074657

Fc1cccc(OCCN(CCOc2cccc(F)c2)C2CCCCCCC2)c1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ KDM1A O60341 1/20 0.38
▸ USP2 O75604 1/20 0.38

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
SCHEMBL23074707 0.86 PPARG (0.42) —
SCHEMBL23074687 0.85 SLC6A9 (0.42) ALDH1A1KDM1A
SCHEMBL23074711 0.83 MEN1 (0.52) ALDH1A1
SCHEMBL23074697 0.82 HTR2A (0.47) ALDH1A1
SCHEMBL23074671 0.82 ALDH1A1 (0.53) ALDH1A1
SCHEMBL23074702 0.81 PARP10 (0.39) ALDH1A1
SCHEMBL30674520 0.78 NFE2L2 (0.54) SLC6A2SLC6A4SLC6A3
SCHEMBL23074691 0.78 SLC6A9 (0.35) ALDH1A1
SCHEMBL23074693 0.77 ADRA1D (0.40) ALDH1A1
SCHEMBL22831321 0.77 CHRNB2 (0.51) ALDH1A1

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-20210069692-A1 ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE CHROMATOGRAPHY RESINS BIO-RAD LABORATORIES, INC. 2021-03-11 — — 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-20210069692-A1 ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE CHROMATOGRAPHY RESINS ABCG2, SLC7A1, MSR1 SLC6A2 469/4885SLC6A4 234/4885SLC6A3 281/4885

“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.

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