SCHEMBL4115256

SCHEMBL4115256

CNC(=O)c1c[nH]nc1C(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
PLK1 P53350 3/20 0.35
POLB P06746 1/20 0.35
KAT2B Q92831 1/20 0.34
BAZ2B Q9UIF8 1/20 0.34
YTHDC1 Q96MU7 1/20 0.32
CREBBP Q92793 1/20 0.32
CHEK1 O14757 1/20 0.31
RET P07949 1/20 0.31
PDGFRB P09619 1/20 0.31
PIM1 P11309 1/20 0.31
PDGFRA P16234 1/20 0.31
GSK3B P49841 1/20 0.31
RPS6KA3 P51812 1/20 0.31
LIMK1 P53667 1/20 0.31
CDK5 Q00535 1/20 0.31
TYRO3 Q06418 1/20 0.31
MAPK14 Q16539 1/20 0.31
LRRK2 Q5S007 1/20 0.31
AURKB Q96GD4 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
SCHEMBL16369379 0.82 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL1218771 0.81 TSHR (0.39) GAAPOLBCREBBPTSHRSMN1; SMN2
SCHEMBL601435 0.78 NOTUM (0.33) HPGDTSHRALDH1A1
SCHEMBL19809947 0.77
SCHEMBL16334638 0.77 ALDH1A1 (0.31) ALDH1A1
SCHEMBL601942 0.77 PLK4 (0.32) CHEK1RETPDGFRACDK5LRRK2
SCHEMBL1218267 0.76 CYP3A4 (0.46) GAAPOLBHPGDHTTALDH1A1
SCHEMBL19809939 0.76 HMGCR (0.34) POLBBAZ2B
SCHEMBL162197 0.74 PLK1 (0.39) GAAPLK1KAT2BBAZ2BYTHDC1
SCHEMBL21621359 0.74 PLK1 (0.39) GAAPLK1YTHDC1CREBBPCHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015116960-A1 COMPOSITIONS FOR HIGH SPEED PRINTING OF CONDUCTIVE MATERIALS FOR ELECTRONIC CIRCUITRY TYPE APPLICATIONS, AND METHODS RELATING E. I. DU PONT DE NEMOURS AND COMPANY (US) 2015-08-06 WO disclosed
US-20090239748-A1 Fungicidal Mixtures Based on 2,5-Disubstituted N-Biphenylpyrazolcarboxamides BASF AKTIENGESELLSCHAFT (DE) 2009-09-24 US disclosed
US-20090233795-A1 Fungicidal Mixtres Based On 3-Monosubstituted N-Bipenyl-Pyrazolecarboxamides BASF AKITENGESELLSCHAFT (DE) 2009-09-17 US disclosed
US-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides BASF AKTIENGESELLSCHAFT (DE) 2009-02-12 US disclosed
US-20090042725-A1 Fungicidal Mixtures Based on 3,5-Disubstituted N-Biphenyl-Pyrazolcarboxamides BASF AKTIENGESELLSCHAFT (DE) 2009-02-12 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 (4 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-20090042725-A1 Fungicidal Mixtures Based on 3,5-Disubstituted N-Biphenyl-Pyrazolcarboxamides CBR3, CBR1, STS GAA 2066/4885PLK1 3866/4885POLB 4048/4885
US-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides CBR3, CBR1, SNU13 GAA 2295/4885PLK1 4308/4885POLB 3502/4885
US-20090239748-A1 Fungicidal Mixtures Based on 2,5-Disubstituted N-Biphenylpyrazolcarboxamides CBR3, CBR1, SNU13 GAA 2614/4885PLK1 4021/4885POLB 3649/4885
US-20090233795-A1 Fungicidal Mixtres Based On 3-Monosubstituted N-Bipenyl-Pyrazolecarboxamides CBR3, CBR1, CYCS GAA 3964/4885PLK1 4074/4885POLB 3470/4885

“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.