SCHEMBL1753476

SCHEMBL1753476

O=c1cc(CO)ccn1-c1ccc(Br)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.38
ALDH1A1 P00352 1/20 0.38
ALOX15 P16050 1/20 0.38
ATM Q13315 1/20 0.38
ALKBH5 Q6P6C2 1/20 0.37
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
POLB P06746 1/20 0.36
FAAH O00519 1/20 0.36
MGLL Q99685 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
F10 P00742 1/20 0.35
VHL P40337 1/20 0.35
ELOC Q15369 1/20 0.35
ELOB Q15370 1/20 0.35
KMT2A Q03164 1/20 0.35
FFAR4 Q5NUL3 2/20 0.34
TYR P14679 1/20 0.34
IDH1 O75874 1/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL7190498 0.82 SMN1; SMN2 (0.55) ALDH1A1GSK3AGSK3BSMN1; SMN2IDH1
SCHEMBL1753846 0.78 FFAR4 (0.34) HTTALDH1A1ALOX15ATMALKBH5
SCHEMBL1753746 0.77 HTT (0.44) HTTALDH1A1ALOX15ATMALKBH5
SCHEMBL1753744 0.74 MCHR1 (0.53) MCHR1
SCHEMBL8107087 0.73 NOTUM (0.43) HTTALDH1A1ALOX15ATMPOLB
SCHEMBL3567338 0.73 HCAR1 (0.36) ALDH1A1SMN1; SMN2VHLELOCELOB
SCHEMBL1753473 0.73 ALDH1A1 (0.41) HTTALDH1A1ALOX15ATMALKBH5
SCHEMBL29348799 0.73 ALDH1A1 (0.41) HTTALDH1A1ALOX15ATMALKBH5
SCHEMBL10087069 0.73 HTT (0.53) HTTALDH1A1ALOX15ATMALKBH5
SCHEMBL1724260 0.71 MCHR1 (0.43) ALDH1A1KMT2AMAPTTSHRMCHR1

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
EP-2102208-B1 NOVEL SUBSTITUTED DIAZA SPIRO PYRIDINONE DERIVATIVES FOR USE IN MCH-1 MEDIATED DISEASES JANSSEN PHARMACEUTICA NV (BE) 2014-04-23 EP disclosed
US-8158643-B2 Substituted diaza-spiro-pyridinone derivatives for use in MCH-1 mediated diseases JANSSEN PHARMACEUTICA N.V. (BE) 2012-04-17 US disclosed
US-8158643-B2 Substituted diaza-spiro-pyridinone derivatives for use in MCH-1 mediated diseases JANSSEN PHARMACEUTICA N.V. (BE) 2012-04-17 US disclosed
US-20100035909-A1 NOVEL SUBSTITUTED DIAZA-SPIRO-PYRIDINONE DERIVATIVES FOR USE IN MCH-1 MEDIATED DISEASES JANSSEN PHARMACEUTICA N.V. (BE) 2010-02-11 US disclosed
US-20100035909-A1 NOVEL SUBSTITUTED DIAZA-SPIRO-PYRIDINONE DERIVATIVES FOR USE IN MCH-1 MEDIATED DISEASES JANSSEN PHARMACEUTICA N.V. (BE) 2010-02-11 US disclosed
WO-2008068265-A1 NOVEL SUBSTITUTED DIAZA SPIRO PYRIDINONE DERIVATIVES FOR USE IN MCH-1 MEDIATED DISEASES JANSSEN PHARMACEUTICA N.V. (BE) 2008-06-12 WO disclosed
WO-2007141200-A1 NOVEL N-ARYL AND N-HETEROARYL SUBSTITUTED PYRIDINONE DERIVATIVES FOR USE IN MCH-1 MEDIATED DISEASES JANSSEN PHARMACEUTICA N.V. (BE) 2007-12-13 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-20100035909-A1 NOVEL SUBSTITUTED DIAZA-SPIRO-PYRIDINONE DERIVATIVES FOR USE IN MCH-1 MEDIATED DISEASES MCHR1, MCHR2, MC1R HTT 636/4885ALDH1A1 281/4885ALOX15 1811/4885

“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.