SCHEMBL13435489

SCHEMBL13435489

COCCN(C/C=C/c1ccccc1)Cc1ccc(OC)cc1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.70
KMT2A Q03164 1/20 0.70
RAB9A P51151 1/20 0.49
MAOB P27338 7/20 0.47
MAOA P21397 3/20 0.47
TRPA1 O75762 1/20 0.46
BCHE P06276 1/20 0.46
TSHR P16473 1/20 0.43
KCNH2 Q12809 1/20 0.42
G6PC1 P35575 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
SCHEMBL2191763 0.86 MEN1 (0.61) MEN1KMT2AMAOBMAOABCHE
SCHEMBL2191761 0.86 MEN1 (0.61) MEN1KMT2AMAOBMAOABCHE
SCHEMBL13912776 0.84 MEN1 (0.65) MEN1KMT2ABCHE
SCHEMBL2190718 0.83 MEN1 (0.64) MEN1KMT2ABCHE
SCHEMBL2190722 0.83 MEN1 (0.64) MEN1KMT2ABCHE
SCHEMBL5752214 0.80 KCNH2 (0.62) RAB9ATRPA1BCHEKCNH2
SCHEMBL5752211 0.80 KCNH2 (0.62) RAB9ATRPA1BCHEKCNH2
SCHEMBL13435492 0.79 MEN1 (0.57) MEN1KMT2ARAB9AMAOBBCHE
SCHEMBL13461850 0.77 MEN1 (0.55) MEN1KMT2AMAOBMAOABCHE
SCHEMBL18064743 0.77 TRPM8 (0.58) MEN1KMT2AKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7671087-B2 Amines that inhibit a mammalian anandamide transporter, and methods of use thereof SEPRACOR INC. (US) 2010-03-02 US disclosed
US-7671087-B2 Amines that inhibit a mammalian anandamide transporter, and methods of use thereof SEPRACOR INC. (US) 2010-03-02 US disclosed
US-20090163593-A1 AMINES THAT INHIBIT A MAMMALIAN ANANDAMIDE TRANSPORTER, AND METHODS OF USE THEREOF AQUILA BRIAN M 2009-06-25 US disclosed
US-20090163593-A1 AMINES THAT INHIBIT A MAMMALIAN ANANDAMIDE TRANSPORTER, AND METHODS OF USE THEREOF AQUILA BRIAN M 2009-06-25 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-20090163593-A1 AMINES THAT INHIBIT A MAMMALIAN ANANDAMIDE TRANSPORTER, AND METHODS OF USE THEREOF SLC6A2, HTR2A, SLC18A1 MEN1 917/4885KMT2A 771/4885RAB9A 801/4885

“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.