SCHEMBL3267563

SCHEMBL3267563

Cc1cc(F)c2ccccc2c1C=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PADI4 Q9UM07 1/20 0.42
ALDH1A1 P00352 3/20 0.41
ERN1 O75460 3/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
TSHR P16473 1/20 0.38
HPRT1 P00492 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ACHE P22303 1/20 0.37
CYP1A2 P05177 5/20 0.37
CYP2C19 P33261 2/20 0.37
CYP2C9 P11712 2/20 0.37
MAPT P10636 1/20 0.37
TNKS2 Q9H2K2 1/20 0.36
CYP2A6 P11509 1/20 0.35
HPGD P15428 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.34
NQO2 P16083 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
SCHEMBL3168552 0.84 PADI4 (0.48) PADI4ALDH1A1ERN1LMNAHTT
SCHEMBL3271795 0.79 ERN1 (0.40) PADI4ALDH1A1ERN1LMNATSHR
SCHEMBL10384781 0.78 ALDH1A1 (0.48) PADI4ALDH1A1ERN1LMNATSHR
SCHEMBL3272295 0.78 ALDH1A1 (0.42) PADI4ALDH1A1ERN1LMNAHTT
SCHEMBL3268207 0.77 PADI4 (0.42) PADI4ALDH1A1ERN1LMNAHTT
SCHEMBL3269246 0.77 ALDH1A1 (0.43) PADI4ALDH1A1ERN1LMNAHTT
SCHEMBL3268788 0.77 PADI4 (0.42) PADI4ALDH1A1ERN1LMNAHTT
SCHEMBL3268264 0.77 HTT (0.57) PADI4ERN1LMNAHTTMEN1
SCHEMBL12521593 0.76 PADI4 (0.41) PADI4ALDH1A1ERN1LMNATSHR
SCHEMBL11302952 0.75 PADI4 (0.48) PADI4ALDH1A1ERN1LMNATSHR

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 PADI4 3251/4885ALDH1A1 381/4885ERN1 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.