SCHEMBL3273985

SCHEMBL3273985

CCc1ccc2cc(F)c(F)cc2c1C=O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.40
ESR2 Q92731 4/20 0.40
ERN1 O75460 3/20 0.38
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
GAA P10253 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL3272561 0.83 MEN1 (0.39) ESR1ESR2ALDH1A1GAATDP1
SCHEMBL3267174 0.78 CYP3A4 (0.34) ESR1ESR2ERN1ALDH1A1CYP3A4
SCHEMBL3267274 0.76 PTGER4 (0.42) ERN1GAATDP1L3MBTL1
SCHEMBL3268893 0.75 ERN1 (0.41) ESR1ESR2ERN1
SCHEMBL3268869 0.75 CYP19A1 (0.39) ESR1ESR2ERN1ALDH1A1CYP3A4
SCHEMBL3268272 0.75 ESR1 (0.35) ESR1ESR2ERN1ALDH1A1CYP3A4
SCHEMBL3267597 0.73 ALB (0.34) ESR1ESR2ERN1ALDH1A1CYP3A4
SCHEMBL3268984 0.73 ERN1 (0.56) ERN1ALDH1A1CYP2C9CYP2C19GAA
SCHEMBL3267177 0.72 CYP3A4 (0.38) ESR1ESR2ERN1ALDH1A1CYP3A4
SCHEMBL3268695 0.71 NSD2 (0.37) ESR1ESR2ERN1ALDH1A1CYP3A4

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 ESR1 4019/4885ESR2 4118/4885ERN1 337/4885

“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.