SCHEMBL23074693

SCHEMBL23074693

Fc1ccc(F)c(OCCN(CCOc2cc(F)ccc2F)C2CCCCCCC2)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ADRA1D P25100 10/20 0.40
▸ CTSB P07858 1/20 0.38
▸ CTSS P25774 1/20 0.38
▸ HTR1D P28221 1/20 0.36
▸ HTR1B P28222 1/20 0.36
▸ PTGDR2 Q9Y5Y4 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ ADRA1A P35348 4/20 0.36
▸ ADRA1B P35368 3/20 0.36

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
SCHEMBL23074689 0.86 ADRA1D (0.39) ADRA1DHTR1DHTR1BALDH1A1LMNA
SCHEMBL23074697 0.79 HTR2A (0.47) ALDH1A1LMNAHTT
SCHEMBL23074702 0.78 PARP10 (0.39) ALDH1A1
SCHEMBL23074657 0.77 SLC6A2 (0.40) ALDH1A1
SCHEMBL22831344 0.77 SLC6A2 (0.44) ADRA1DHTR1DHTR1B
SCHEMBL23074687 0.76 SLC6A9 (0.42) ALDH1A1TSHRHSD17B10
SCHEMBL23074691 0.75 SLC6A9 (0.35) ALDH1A1TSHRHSD17B10MAPT
SCHEMBL23074690 0.74 ALDH1A1 (0.56) ADRA1DALDH1A1ADRA1AADRA1B
SCHEMBL23074696 0.74 LMNA (0.52) HTR1DHTR1BALDH1A1LMNAHPGD
SCHEMBL22831334 0.73 HTR7 (0.50) HTR1BALDH1A1MAPT

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 ADRA1D 2405/4885CTSB 2497/4885CTSS 2699/4885

“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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