SCHEMBL2219230

SCHEMBL2219230

COc1ccc(OC2CCN(C(=O)c3cccc(OC)c3)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.57
HSD11B1 P28845 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 1/20 0.54
DRD2 P14416 1/20 0.54
DRD3 P35462 1/20 0.54
PDE4B Q07343 1/20 0.52
GFER P55789 1/20 0.52
POLB P06746 1/20 0.51
HPGD P15428 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
UBE2M P61081 1/20 0.50
DCUN1D1 Q96GG9 1/20 0.50

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
SCHEMBL2219227 1.00 MGLL (0.57) MGLLHSD11B1L3MBTL1ALDH1A1KDM4E
SCHEMBL2217300 0.94 MGLL (0.58) MGLLHSD11B1L3MBTL1ALDH1A1KDM4E
SCHEMBL2217297 0.94 MGLL (0.58) MGLLHSD11B1L3MBTL1ALDH1A1KDM4E
SCHEMBL1580394 0.91 HRH1 (0.56) MGLLHSD11B1ALDH1A1KDM4EHPGD
SCHEMBL1581719 0.91 MGLL (0.60) MGLLHSD11B1ALDH1A1POLBHPGD
SCHEMBL12442701 0.91 GPR183 (0.55) MGLLHSD11B1L3MBTL1ALDH1A1HPGD
SCHEMBL1581722 0.91 MGLL (0.60) MGLLHSD11B1ALDH1A1POLBHPGD
SCHEMBL2219252 0.90 HSD11B1 (0.56) MGLLHSD11B1L3MBTL1ALDH1A1KDM4E
SCHEMBL2219256 0.90 HSD11B1 (0.56) MGLLHSD11B1L3MBTL1ALDH1A1KDM4E
SCHEMBL2219630 0.90 ALDH1A1 (0.61) HSD11B1L3MBTL1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785452-B2 Anti-infective compounds INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 2014-07-22 US disclosed
EP-2730576-A2 Anti-infective compounds Institut Pasteur Korea (KR) 2014-05-14 EP disclosed
US-20110178077-A1 Anti-infective compounds INSTITUT PASTEUR KOREA (KR) 2011-07-21 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-20110178077-A1 Anti-infective compounds RABGGTB, ELANE, SERPINB1 MGLL 692/4885HSD11B1 3190/4885L3MBTL1 643/4885

“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.