SCHEMBL4404036

SCHEMBL4404036

Brc1cccc(COc2cccc(Br)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 14/20 1.00
MAOA P21397 4/20 0.71
MRGPRX4 Q96LA9 1/20 0.69
NPC1 O15118 1/20 0.63
ALDH1A1 P00352 1/20 0.63
RAB9A P51151 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
PARP15 Q460N3 2/20 0.60
PARP10 Q53GL7 2/20 0.60
IDO1 P14902 1/20 0.60
AGXT P21549 1/20 0.60
PARP14 Q460N5 1/20 0.59

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
SCHEMBL29666660 0.90 MAOB (1.00) MAOBMAOAMRGPRX4NPC1ALDH1A1
SCHEMBL13469158 0.90 MAOB (0.82) MAOBMAOAMRGPRX4PARP15PARP10
SCHEMBL73864 0.90 MAOB (1.00) MAOBMAOAMRGPRX4NPC1ALDH1A1
SCHEMBL17978716 0.89 MAOB (0.96) MAOBMAOAMRGPRX4NPC1ALDH1A1
SCHEMBL810741 0.88 MAOB (0.77) MAOBMAOAMRGPRX4NPC1ALDH1A1
SCHEMBL16795550 0.88 MAOB (1.00) MAOBMAOAMRGPRX4PARP15
SCHEMBL810530 0.88 MAOB (0.77) MAOBMAOAMRGPRX4NPC1ALDH1A1
SCHEMBL16795515 0.88 MAOB (1.00) MAOBMAOAMRGPRX4NPC1ALDH1A1
SCHEMBL16795545 0.88 MAOB (0.88) MAOBMAOAMRGPRX4PARP15PARP10
SCHEMBL16795652 0.88 MAOB (0.88) MAOBMAOAMRGPRX4IDO1AGXT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7553809-B2 Fc receptor modulators and uses thereof ILEXUS PTY LIMITED (AU) 2009-06-30 US disclosed
US-20060057144-A1 Fc receptor modulators and uses thereof ILEXUS PTY LIMITED (AU) 2006-03-16 US disclosed
US-6835753-B2 Administering to the patient for inhibiting Fc receptor binding of immunoglobulin a compound selected from aromatic, heteroaromatic, cyclic, bicyclic and an amino acid derivative or salt ILEXUS PTY LIMITED (AU) 2004-12-28 US disclosed
EP-1109545-A4 Fc RECEPTOR MODULATORS AND USES THEREOF ILEXUS PTY LTD (AU) 2004-11-10 EP disclosed
US-20020061844-A1 Administering to the patient for inhibiting Fc receptor binding of immunoglobulin a compound selected from aromatic, heteroaromatic, cyclic, bicyclic and an amino acid derivative or salt ILEXUS PTY LIMITED 2002-05-23 US disclosed
US-6355683-B1 ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASE ILEXUS PTY LIMITED (AU) 2002-03-12 US disclosed
EP-1109545-A1 Fc RECEPTOR MODULATORS AND USES THEREOF ILEXUS PTY LTD (AU) 2001-06-27 EP disclosed
WO-2000015214-A1 Fc RECEPTOR MODULATORS AND USES THEREOF ILEXUS PTY LIMITED (US) 2000-03-23 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 (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-20020061844-A1 Administering to the patient for inhibiting Fc receptor binding of immunoglobulin a compound selected from aromatic, heteroaromatic, cyclic, bicyclic and an amino acid derivative or salt FCGR2A, FCGR1A, FCER2 MAOB 1355/4885MAOA 748/4885MRGPRX4 98/4885
US-20060057144-A1 Fc receptor modulators and uses thereof FCGR1A, FCER2, FCGR2A MAOB 1334/4885MAOA 1307/4885MRGPRX4 106/4885

“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.