SCHEMBL4298176

SCHEMBL4298176

NC1C[C@H](COc2ccccc2)N(C(=O)O)C1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1D1 P20393 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CFD P00746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
FFAR4 Q5NUL3 3/20 0.38
GRM2 Q14416 1/20 0.38
ALOX15 P16050 1/20 0.38
ABHD6 Q9BV23 1/20 0.37
DAGLA Q9Y4D2 1/20 0.37
ITGA4 P13612 1/20 0.36

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
SCHEMBL3950648 1.00 NR1D1 (0.40) NR1D1MEN1KMT2ACFDTDP1
SCHEMBL4289909 0.88 S1PR5 (0.41) NR1D1MEN1KMT2AFFAR4ABHD6
SCHEMBL3954880 0.88 GRIN2C (0.41) NR1D1TDP1GRM2ITGA4
SCHEMBL4303403 0.87 HPGD (0.41) CFD
SCHEMBL6974057 0.87 NR1D1 (0.41) NR1D1MEN1KMT2ATDP1FFAR4
SCHEMBL3945694 0.87 NR1D1 (0.41) NR1D1MEN1KMT2ATDP1FFAR4
SCHEMBL8061878 0.83 SRC (0.43) NR1D1
SCHEMBL4294638 0.81 AGTR2 (0.46) NR1D1ABHD6DAGLA
SCHEMBL6978115 0.81 AGTR2 (0.46) NR1D1ABHD6DAGLA
Hydrochloric Acid SCHEMBL13386633 0.77 ADRB2 (0.42) MEN1KMT2A

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-8598202-B2 Aryl-hydroxyethylamino-pyrimidines and triazines as modulators of fatty acid amide hydrolase JANSSEN PHARMACEUTICA NV (BE) 2013-12-03 US claimed
EP-2254415-B1 ARYL-HYDROXYETHYLAMINO-PYRIMIDINES AND TRIAZINES AS MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2013-01-23 EP claimed
US-20090264429-A1 Aryl - Hydroxyethylamino - Pyrimidines and Triazines as Modulators of Fatty Acid amide Hydrolase JANSSEN PHARMACEUTICA NV (BE) 2009-10-22 US claimed
US-8598202-B2 Aryl-hydroxyethylamino-pyrimidines and triazines as modulators of fatty acid amide hydrolase JANSSEN PHARMACEUTICA NV (BE) 2013-12-03 US disclosed
EP-2254415-B1 ARYL-HYDROXYETHYLAMINO-PYRIMIDINES AND TRIAZINES AS MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2013-01-23 EP disclosed
US-20090264429-A1 Aryl - Hydroxyethylamino - Pyrimidines and Triazines as Modulators of Fatty Acid amide Hydrolase JANSSEN PHARMACEUTICA NV (BE) 2009-10-22 US disclosed
US-20090264431-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-10-22 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-20090264431-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE CTSB, CTSS, CTSF NR1D1 1663/4885MEN1 4571/4885KMT2A 3612/4885
US-20090264429-A1 Aryl - Hydroxyethylamino - Pyrimidines and Triazines as Modulators of Fatty Acid amide Hydrolase FAAH, FAAH2, HRH2 NR1D1 383/4885MEN1 4767/4885KMT2A 500/4885

“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.