SCHEMBL13523866

SCHEMBL13523866

COc1ccc2cc(OCc3ccccc3)cc(CCN)c2c1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MAPT P10636 1/20 0.53
LTA4H P09960 2/20 0.52
PLA2G2A P14555 2/20 0.52
MAOB P27338 3/20 0.51
ALOX5 P09917 1/20 0.49
ADRA1A P35348 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
MTNR1A P48039 1/20 0.47

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
SCHEMBL13523858 0.85 MAOB (0.52) MAOBALOX5MTNR1A
SCHEMBL13523859 0.85 MAOB (0.52) MAOBALOX5MTNR1A
SCHEMBL13523863 0.81 MAOB (0.49) MAOBALOX5MTNR1A
SCHEMBL13523864 0.81 MTNR1A (0.74) MTNR1A
SCHEMBL6375516 0.80 ADRA1A (0.65) ADRA1ATAAR1MTNR1A
SCHEMBL6382816 0.78 ADRA1A (0.65) TRPM8KDM4EMAPTLTA4HPLA2G2A
SCHEMBL13523861 0.76 MAOB (0.58) MAOBALOX5
SCHEMBL13523860 0.76 MAOB (0.51) MAOBALOX5
SCHEMBL20562784 0.75 TAAR1 (0.51) TRPM8MAPTADRA1ATAAR1
SCHEMBL29594789 0.74 HTR2A (0.68) MTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004340-A1 NAPHTHYL(ETHYL) ACETAMIDES CONCERT PHARMACEUTICALS, INC. (US) 2010-01-07 US disclosed
US-20100004340-A1 NAPHTHYL(ETHYL) ACETAMIDES CONCERT PHARMACEUTICALS, INC. (US) 2010-01-07 US disclosed
US-7608737-B2 Naphthyl(ethyl)acetamides Concert Pharmaceuticasl Inc. (US) 2009-10-27 US disclosed
US-7608737-B2 Naphthyl(ethyl)acetamides Concert Pharmaceuticasl Inc. (US) 2009-10-27 US disclosed
US-20080280908-A1 NAPHTHYL(ETHYL) ACETAMIDES CONCERT PHARMACEUTICALS INC. (US) 2008-11-13 US disclosed
US-20080280908-A1 NAPHTHYL(ETHYL) ACETAMIDES CONCERT PHARMACEUTICALS INC. (US) 2008-11-13 US disclosed
WO-2008137461-A1 NAPHTHYL(ETHYL) ACETAMIDES CONCERT PHARMACEUTICALS INC. (US) 2008-11-13 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 (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-20080280908-A1 NAPHTHYL(ETHYL) ACETAMIDES AANAT, MTNR1A, TPH2 TRPM8 472/4885KDM4E 3270/4885MAPT 836/4885
US-20100004340-A1 NAPHTHYL(ETHYL) ACETAMIDES AANAT, MTNR1A, TPH2 TRPM8 472/4885KDM4E 3270/4885MAPT 836/4885

“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.