SCHEMBL22340945

SCHEMBL22340945

CCCC(C)N(CCC)Cc1ccc(OC)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.56
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
APLNR P35414 1/20 0.41
SLC6A4 P31645 1/20 0.41
AOC3 Q16853 3/20 0.41
TAS2R14 Q9NYV8 1/20 0.40
PYCR1 P32322 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
POLB P06746 1/20 0.38
IDO1 P14902 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
SCHEMBL22340659 0.90 BCHE (0.52) BCHEHTTSMN1; SMN2APLNRSLC6A4
SCHEMBL20870840 0.88 BCHE (0.52) BCHEHTTSMN1; SMN2LMNA
SCHEMBL22340949 0.86 BCHE (0.62) BCHESMN1; SMN2AOC3TAS2R14LMNA
SCHEMBL20871279 0.85 APLNR (0.49) BCHEAPLNRSLC6A4AOC3TAS2R14
SCHEMBL13286274 0.85 BCHE (0.46) BCHETAS2R14
SCHEMBL20871191 0.82 SMN1; SMN2 (0.45) BCHEHTTSMN1; SMN2APLNRSLC6A4
SCHEMBL22340957 0.78 MAPT (0.55) HTTSMN1; SMN2TAS2R14L3MBTL1LMNA
SCHEMBL20871412 0.78 HTT (0.42) HTTSMN1; SMN2APLNRSLC6A4PYCR1
SCHEMBL22340675 0.77 BCHE (0.58) BCHESMN1; SMN2AOC3TAS2R14LMNA
SCHEMBL23058158 0.76 BCHE (0.58) BCHESMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11034646-B2 Method for the synthesis of unsymmetrical tertiary amines Universite Paris-Saclay (FR) 2021-06-15 US disclosed
US-20200255369-A1 NEW METHOD FOR THE SYNTHESIS OF UNSYMMETRICAL TERTIARY AMINES Universite Paris-Saclay (FR) 2020-08-13 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 (2 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-20200255369-A1 NEW METHOD FOR THE SYNTHESIS OF UNSYMMETRICAL TERTIARY AMINES ADH1C, ADH1A, ADH5 BCHE 307/4885HTT 2812/4885SMN1; SMN2 2857/4885
US-11034646-B2 Method for the synthesis of unsymmetrical tertiary amines ADH1C, PNMT, ADH1A BCHE 256/4885HTT 2436/4885SMN1; SMN2 2752/4885

“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.