SCHEMBL4853715

SCHEMBL4853715

CN(C)CCOc1ccc(-c2ccccc2)cc1C=O

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.60
KDM4E B2RXH2 2/20 0.60
MAPT P10636 2/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
HTR7 P34969 1/20 0.54
ADRB2 P07550 2/20 0.52
ADRB1 P08588 2/20 0.52
SLC6A9 P48067 9/20 0.52
SMN1; SMN2 Q16637 1/20 0.51
ESR1 P03372 1/20 0.50
MCHR1 Q99705 1/20 0.50
DRD2 P14416 1/20 0.48
DRD1 P21728 1/20 0.48
DRD4 P21917 1/20 0.48
DRD5 P21918 1/20 0.48
LSS P48449 1/20 0.48
HRH1 P35367 1/20 0.46

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
SCHEMBL4852503 1.00 ALDH1A1 (0.60) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4849767 0.89 KDM4E (0.47) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4849200 0.88 KDM4E (0.47) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4849949 0.84 ADRB2 (0.45) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4853655 0.84 ERN1 (0.53) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4845580 0.84 SLC6A9 (0.49) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4854610 0.83 ALDH1A1 (0.49) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4854673 0.83 ERN1 (0.51) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4853912 0.83 HTR7 (0.54) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4856307 0.83 HTR7 (0.48) ALDH1A1KDM4EMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7423181-B2 in particular against bacterial and parasitic infections, fungi, and helminths; improved metabolic and physiochemical properties, bioavailability, solubility; 3-[4-(2-Dimethylamino-ethoxy)-2'-trifluoromethyl-biphenyl-3-yl]-1-(2-dimethylaminomethyl-phenyl)-propenone LICA PHARMACEUTICALS A/S (DK) 2008-09-09 US disclosed
US-20080027075-A1 Quaternary Amino-Function Chalcones LICA PHARMACEUTICALS A/S (DK) 2008-01-31 US disclosed
US-20080027075-A1 Quaternary Amino-Function Chalcones LICA PHARMACEUTICALS A/S (DK) 2008-01-31 US disclosed
US-20080027075-A1 Quaternary Amino-Function Chalcones LICA PHARMACEUTICALS A/S (DK) 2008-01-31 US disclosed
EP-1682486-A1 QUATERNARY AMINO-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2006-07-26 EP disclosed
US-20050227990-A1 Aminoalkoxy-functional chalcones LICA PHARMACEUTICALS A/S (DK) 2005-10-13 US disclosed
WO-2005042467-A1 QUATERNARY AMINO-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2005-05-12 WO disclosed
EP-1515940-A2 AMINOALKOXY-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2005-03-23 EP disclosed
WO-2003097574-A2 AMINOALKOXY-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2003-11-27 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 (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-20080027075-A1 Quaternary Amino-Function Chalcones NR2E1, BET1, NR0B1 ALDH1A1 4517/4885KDM4E 747/4885MAPT 4666/4885

“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.