SCHEMBL18199761

SCHEMBL18199761

COc1ccc(CCN2CCN(C(=O)C(O)(c3ccccc3)C3CCCC3)CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CHRM3 P20309 18/20 1.00

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
SCHEMBL20202493 0.90 CHRM3 (1.00) CHRM3
SCHEMBL20202497 0.87 CHRM3 (1.00) CHRM3
SCHEMBL18199762 0.84 CHRM3 (1.00) CHRM3
SCHEMBL18199573 0.83 CHRM3 (1.00) CHRM3
SCHEMBL20202494 0.82 CHRM3 (1.00) CHRM3
SCHEMBL18199759 0.82 CHRM3 (1.00) CHRM3
SCHEMBL1996647 0.82 CHRM3 (0.69) CHRM3
SCHEMBL1996643 0.82 CHRM3 (0.69) CHRM3
SCHEMBL18199578 0.81 CHRM3 (1.00) CHRM3
SCHEMBL18199760 0.80 CHRM3 (1.00) CHRM3

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-20180148425-A1 N-ARALKYLCARBONYL-PIPERAZINE AND -HOMOPIPERAZINE COMPOUNDS AND PERSONAL CARE COMPOSITIONS COMPRISING THE SAME CONOPCO, INC., D/B/A UNILEVER (US) 2018-05-31 — — US disclosed
US-20180148425-A1 N-ARALKYLCARBONYL-PIPERAZINE AND -HOMOPIPERAZINE COMPOUNDS AND PERSONAL CARE COMPOSITIONS COMPRISING THE SAME CONOPCO, INC., D/B/A UNILEVER (US) 2018-05-31 — — US disclosed
WO-2016173817-A1 N-ARALKYLCARBONYL-PIPERAZINE AND -HOMOPIPERAZINE COMPOUNDS AND PERSONAL CARE COMPOSITIONS COMPRISING THE SAME UNILEVER PLC (GB) 2016-11-03 — — WO 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-20180148425-A1 N-ARALKYLCARBONYL-PIPERAZINE AND -HOMOPIPERAZINE COMPOUNDS AND PERSONAL CARE COMPOSITIONS COMPRISING THE SAME MKI67, CUTA, PLP2 CHRM3 3141/4885

“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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