SCHEMBL16624140

SCHEMBL16624140

Cc1ccc(COC(=O)N2CCC3(CC2)CC(Br)=NO3)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 5/20 0.47
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 4/20 0.42
GAA P10253 1/20 0.42
ALOX15 P16050 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
P2RX4 Q99571 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
KDM1A O60341 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL12901520 0.89 GRIN2B (0.47) GRIN2BKMT2AMEN1ALDH1A1GAA
SCHEMBL12901522 0.89 ENPP2 (0.48) GRIN2BKMT2AMEN1ALDH1A1GAA
SCHEMBL12901486 0.88 MEN1 (0.54) GRIN2BKMT2AMEN1ALDH1A1GAA
SCHEMBL12901516 0.77 JAK2 (0.38) KMT2AMEN1ALDH1A1L3MBTL1HDAC3
SCHEMBL12901497 0.77 TEAD1 (0.49) KMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL12901515 0.76 CYP3A4 (0.43) KMT2AMEN1ALDH1A1
SCHEMBL16624139 0.75 GPR119 (0.35) KMT2AMEN1ALDH1A1ALOX15SMN1; SMN2
SCHEMBL12901519 0.75 KMT2A (0.34) KMT2AMEN1ALDH1A1SMN1; SMN2NPSR1
SCHEMBL7384158 0.74 KMT2A (0.59) GRIN2BKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL12901552 0.74 MEN1 (0.48) GRIN2BKMT2AMEN1ALDH1A1GAA

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-20150099738-A1 ISOXAZOLINES AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. 2015-04-09 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-20150099738-A1 ISOXAZOLINES AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, HRH2 GRIN2B 1025/4885KMT2A 2280/4885MEN1 4812/4885

“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.