SCHEMBL22340747

SCHEMBL22340747

CCCCN(Cc1cccc(OC)c1)c1ccc(OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 4/20 0.49
NR1H3 Q13133 4/20 0.49
QPCT Q16769 1/20 0.48
CALM1 P0DP23 1/20 0.46
CAMKK2 Q96RR4 1/20 0.46
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
AOC3 Q16853 1/20 0.44
CNR2 P34972 1/20 0.43
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
EPHX2 P34913 2/20 0.42
CETP P11597 1/20 0.42

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
SCHEMBL20871152 0.96 CNR2 (0.47) NR1H2NR1H3QPCTCALM1CAMKK2
SCHEMBL29334921 0.95 CNR2 (0.49) NR1H2NR1H3QPCTCALM1CAMKK2
SCHEMBL22340698 0.95 CNR2 (0.49) NR1H2NR1H3QPCTCALM1CAMKK2
SCHEMBL20870816 0.95 CNR2 (0.49) NR1H2NR1H3QPCTCALM1CAMKK2
SCHEMBL20871827 0.95 CNR2 (0.49) NR1H2NR1H3QPCTCALM1CAMKK2
SCHEMBL20871434 0.95 CNR2 (0.49) NR1H2NR1H3QPCTCALM1CAMKK2
SCHEMBL20871185 0.92 QPCT (0.50) QPCTCALM1CAMKK2MTNR1AMTNR1B
SCHEMBL29334252 0.88 NR1H2 (0.46) NR1H2NR1H3CNR2
SCHEMBL20871034 0.86 MTNR1A (0.53) NR1H2NR1H3MTNR1AMTNR1BCNR2
SCHEMBL22340432 0.85 QPCT (0.52) QPCTCALM1CAMKK2AOC3CNR2

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
EP-3707132-B1 NEW METHOD FOR THE SYNTHESIS OF UNSYMMETRICAL TERTIARY AMINES UNIV PARIS SACLAY (FR) 2024-07-17 EP disclosed
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 NR1H2 2808/4885NR1H3 2343/4885QPCT 988/4885
US-11034646-B2 Method for the synthesis of unsymmetrical tertiary amines ADH1C, PNMT, ADH1A NR1H2 2795/4885NR1H3 2300/4885QPCT 998/4885

“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.