SCHEMBL4537433

SCHEMBL4537433

Cc1ccc2cc(-n3ccc(O)cc3=O)ccc2n1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.44
KDM4E B2RXH2 2/20 0.41
POLB P06746 2/20 0.41
LMNA P02545 1/20 0.41
CASP6 P55212 1/20 0.41
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
SCD O00767 4/20 0.36
MCHR1 Q99705 1/20 0.36
KDM1A O60341 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
LCK P06239 1/20 0.34
KIT P10721 1/20 0.34
SRC P12931 1/20 0.34

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
SCHEMBL4526576 0.79 MCHR1 (0.37) SCDMCHR1
SCHEMBL4538072 0.78 PIM1 (0.43) CYP1A2MCHR1
SCHEMBL13677542 0.77 PDE10A (0.41) CYP1A2KDM4EPOLBLMNACASP6
SCHEMBL15111887 0.76 MCHR1 (0.58) KDM4ELMNAMCHR1
SCHEMBL4540805 0.76 MCHR1 (0.61) MCHR1
SCHEMBL4532727 0.76 MCHR1 (0.45) CYP1A2KDM4EMCHR1SRC
SCHEMBL4541909 0.75 KCNH2 (0.47) CYP1A2LMNAMCHR1KMT2A
SCHEMBL906951 0.74 CYP1A2 (0.63) CYP1A2KDM4EPOLBLMNACASP6
SCHEMBL31428865 0.74 CYP1A2 (0.63) CYP1A2KDM4EPOLBLMNACASP6
SCHEMBL4532080 0.74 MCHR1 (0.66) MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264426-A1 Bicyclic aromatic substituted pyridone derivative MSD K.K. (JP) 2009-10-22 US disclosed
EP-1939194-A1 BICYCLIC AROMATIC SUBSTITUTED PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-07-02 EP 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-20090264426-A1 Bicyclic aromatic substituted pyridone derivative PYCR1, CHRM1, MTR CYP1A2 73/4885KDM4E 1819/4885POLB 2928/4885

“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.