SCHEMBL3039092

SCHEMBL3039092

CC(C(O)c1ccc(OCc2ccccc2)cc1)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.57
BCHE P06276 2/20 0.54
ALOX5 P09917 3/20 0.52
PTGS1 P23219 2/20 0.50
PTGS2 P35354 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
SLC6A2 P23975 1/20 0.49
CYP2C19 P33261 1/20 0.49
SLC6A3 Q01959 1/20 0.49
HIF1A Q16665 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAPT P10636 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
SCHEMBL9841040 0.83 KDM4E (0.58) NPY5RLMNASLC6A2CYP2C19SLC6A3
SCHEMBL2636610 0.83 KDM4E (0.58) NPY5RLMNASLC6A2CYP2C19SLC6A3
SCHEMBL2636608 0.83 KDM4E (0.58) NPY5RLMNASLC6A2CYP2C19SLC6A3
SCHEMBL11606393 0.82 LMNA (0.66) BCHEALOX5PTGS1PTGS2L3MBTL1
SCHEMBL11606605 0.80 LMNA (0.63) NPY5RBCHEPTGS1PTGS2L3MBTL1
SCHEMBL21360221 0.80 LMNA (0.58) NPY5RALOX5PTGS1PTGS2L3MBTL1
SCHEMBL1497960 0.79 LMNA (0.61) ALOX5PTGS1PTGS2L3MBTL1LMNA
SCHEMBL24330472 0.77 KDM4E (0.44) LMNAMEN1KMT2ANPSR1
SCHEMBL5884767 0.77 LTA4H (0.58) NPY5RALOX5L3MBTL1LMNA
SCHEMBL8440300 0.76 BCHE (0.58) BCHEALOX5PTGS1PTGS2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100081845-A1 Process for Production of Optically Active Benzylamine Derivatives ALPS PHARMACEUTICAL INC. CO., LTD. (JP) 2010-04-01 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-20100081845-A1 Process for Production of Optically Active Benzylamine Derivatives RAB27A, HTR7, ALKBH1 NPY5R 2279/4885BCHE 430/4885ALOX5 1571/4885

“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.