SCHEMBL3268869

SCHEMBL3268869

CCc1ccc2c(F)cc(F)cc2c1C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.39
ERN1 O75460 2/20 0.33
ALDH1A1 P00352 4/20 0.32
HTT P42858 1/20 0.32
ESR1 P03372 2/20 0.32
ESR2 Q92731 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 1/20 0.31
PDE10A Q9Y233 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL3267597 0.85 ALB (0.34) CYP19A1ERN1ALDH1A1ESR1ESR2
SCHEMBL3267174 0.80 CYP3A4 (0.34) ERN1ALDH1A1ESR1ESR2MEN1
SCHEMBL3268857 0.79 ERN1 (0.42) CYP19A1ERN1ALDH1A1HTTMEN1
SCHEMBL3267516 0.79 ALB (0.40) ERN1ALDH1A1HTTESR1ESR2
SCHEMBL3272561 0.78 MEN1 (0.39) CYP19A1ALDH1A1HTTESR1ESR2
SCHEMBL3268272 0.77 ESR1 (0.35) ERN1ALDH1A1ESR1ESR2MEN1
SCHEMBL3272295 0.76 ALDH1A1 (0.42) ERN1ALDH1A1HTTMEN1KMT2A
SCHEMBL3267632 0.76 ERN1 (0.35) ERN1ALDH1A1HTTMEN1KMT2A
SCHEMBL3273985 0.75 ESR1 (0.40) ERN1ALDH1A1ESR1ESR2CYP3A4
SCHEMBL10224884 0.74 ERN1 (0.39) ERN1ALDH1A1HTTESR1ESR2

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
EP-1914229-B1 NOVEL CERCOSPORAMIDE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2010-06-16 EP disclosed
US-20090036492-A1 Novel Cercosporamide Derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-02-05 US disclosed
EP-1914229-A1 NOVEL CERCOSPORAMIDE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2008-04-23 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-20090036492-A1 Novel Cercosporamide Derivative GPR119, CBR3, SLC5A2 CYP19A1 2116/4885ERN1 337/4885ALDH1A1 381/4885

“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.