SCHEMBL3603041

SCHEMBL3603041

COC(=O)c1cc(C(=O)Cl)ccc1NC(=O)C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 4/20 0.48
PDK2 Q15119 4/20 0.48
PDK3 Q15120 4/20 0.48
PDK4 Q16654 4/20 0.48
KDM4E B2RXH2 8/20 0.48
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP2D6 P10635 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C9 P11712 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 8/20 0.39
HPGD P15428 6/20 0.39
POLB P06746 1/20 0.39
GAA P10253 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 3/20 0.38
GLA P06280 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38

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
SCHEMBL3605714 0.90 KDM4E (0.58) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL6218278 0.87 KDM4E (0.49) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL1573269 0.84 KCNK2 (0.46) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL4506821 0.81 ALDH1A1 (0.45) KDM4ECYP1A2CYP2C19TSHRCYP2C9
SCHEMBL219552 0.80 ALDH1A1 (0.59) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL27953738 0.76 KMT2A (0.63) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL19058584 0.75 PDK2 (0.54) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL979300 0.74 PDK2 (0.53) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL31613155 0.74 KMT2A (0.46) KDM4ECYP1A2CYP2C19CYP2D6TSHR
SCHEMBL30822002 0.74 KMT2A (0.46) KDM4ECYP1A2CYP2C19CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9120819-B2 FGF-receptor agonist dimeric compounds SANOFI (FR) 2015-09-01 US disclosed
US-7803811-B2 1,2,3-substituted indolizine derivatives, inhibitors of FGFs, method for preparing them and pharmaceutical compositions containing them SANOFI-AVENTIS (FR) 2010-09-28 US disclosed
US-20090069368-A1 FGF-RECEPTOR AGONIST DIMERIC COMPOUNDS SANOFI-AVENTIS (FR) 2009-03-12 US disclosed
US-20090023770-A1 Novel 1,2,3-Substituted Indolizine Derivatives, Inhibitors of FGFs, Method for Preparing Them and Pharmaceutical Compositions Containing Them SANOFI-AVENTIS (FR) 2009-01-22 US disclosed
US-7442708-B2 1,2,3-substituted indolizine derivatives, inhibitors of fgfs, method for making same and pharmaceutical compositions containing same SANOFI-AVENTIS (FR) 2008-10-28 US disclosed
US-20050203126-A1 Novel 1,2,3-substituted indolizine derivatives, inhibitors of fgfs, method for making same and pharmaceutical compositions containing same SANOFI (FR) 2005-09-15 US 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 (3 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-20050203126-A1 Novel 1,2,3-substituted indolizine derivatives, inhibitors of fgfs, method for making same and pharmaceutical compositions containing same FGFR3, FGFR1, NTRK3 PDK1 2430/4885PDK2 1447/4885PDK3 682/4885
US-20090069368-A1 FGF-RECEPTOR AGONIST DIMERIC COMPOUNDS FGF2, FGFR1, FGF1 PDK1 1950/4885PDK2 1852/4885PDK3 3056/4885
US-20090023770-A1 Novel 1,2,3-Substituted Indolizine Derivatives, Inhibitors of FGFs, Method for Preparing Them and Pharmaceutical Compositions Containing Them FGF2, FGF1, FGFR1 PDK1 2153/4885PDK2 1295/4885PDK3 1742/4885

“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.